loadScript ../packages/jsmol/j2s/core/package.js
loadScript ../packages/jsmol/j2s/core/corejmol.z.js
loadScript ../packages/jsmol/j2s/J/translation/PO.js
loadScript ../packages/jsmol/j2s/core/corescript.z.js
JSmol exec MoleculeDisplay load JSExporter J.export.JSExporter
loadScript ../packages/jsmol/j2s/J/export/JSExporter.js
loadScript ../packages/jsmol/j2s/J/export/___Exporter.js
loadScript ../packages/jsmol/j2s/J/export/Export3D.js
loadScript ../packages/jsmol/j2s/J/export/__CartesianExporter.js
loadScript ../packages/jsmol/j2s/J/g3d/HermiteRenderer.js
loadScript ../packages/jsmol/j2s/J/export/UseTable.js
JSmol exec MoleculeDisplay start applet null
Jmol JavaScript applet MoleculeDisplay__2344842034404704__ initializing
Jmol getValue debug null
Jmol getValue logLevel null
Jmol getValue allowjavascript null
AppletRegistry.checkIn(MoleculeDisplay__2344842034404704__)
vwrOptions:
{ "name":"MoleculeDisplay","applet":true,"documentBase":"https://webbook.nist.gov/cgi/cbook.cgi?Str3View=R441393&Type=JSmol","platform":"J.awtjs.Platform","fullName":"MoleculeDisplay__2344842034404704__","codePath":"https://webbook.nist.gov/cgi/../packages/jsmol/j2s/","signedApplet":"true","appletReadyCallback":"Jmol._readyCallback","statusListener":"[J.appletjs.Jmol object]","script":";set multipleBondSpacing 0.35;","syncId":"2344842034404704","bgcolor":"black" }
setting document base to "https://webbook.nist.gov/cgi/cbook.cgi?Str3View=R441393&Type=JSmol"
(C) 2015 Jmol Development
Jmol Version: 14.29.53 2019-08-18 15:32
java.vendor: Java2Script (WebGL)
java.version: 2019-06-08 00:17:46 (JSmol/j2s)
os.name: Mozilla/5.0 AppleWebKit/537.36 (KHTML, like Gecko; compatible; ClaudeBot/1.0; +claudebot@anthropic.com)
Access: ALL
memory: 0.0/0.0
processors available: 1
useCommandThread: false
appletId:MoleculeDisplay (signed)
Jmol getValue emulate null
defaults = "Jmol"
Jmol getValue boxbgcolor null
Jmol getValue bgcolor black
backgroundColor = "black"
Jmol getValue ANIMFRAMECallback null
Jmol getValue APPLETREADYCallback Jmol._readyCallback
APPLETREADYCallback = "Jmol._readyCallback"
StatusManager callback set for APPLETREADYCallback f=Jmol._readyCallback cb=APPLETREADY
Jmol getValue ATOMMOVEDCallback null
Jmol getValue AUDIOCallback null
Jmol getValue CLICKCallback null
Jmol getValue DRAGDROPCallback null
Jmol getValue ECHOCallback null
Jmol getValue ERRORCallback null
Jmol getValue EVALCallback null
Jmol getValue HOVERCallback null
Jmol getValue IMAGECallback null
Jmol getValue LOADSTRUCTCallback null
Jmol getValue MEASURECallback null
Jmol getValue MESSAGECallback null
Jmol getValue MINIMIZATIONCallback null
Jmol getValue SERVICECallback null
Jmol getValue PICKCallback null
Jmol getValue RESIZECallback null
Jmol getValue SCRIPTCallback null
Jmol getValue SYNCCallback null
Jmol getValue STRUCTUREMODIFIEDCallback null
Jmol getValue doTranslate null
language=en_US
Jmol getValue popupMenu null
Jmol getValue script ;set multipleBondSpacing 0.35;
Jmol getValue loadInline null
Jmol getValue load null
script 1 started
multipleBondSpacing = 0.35
Script completed
Jmol script terminated
loadScript ../packages/jsmol/j2s/core/coreprop.z.js
loadScript ../packages/jsmol/j2s/JU/XmlUtil.js
Jmol applet MoleculeDisplay__2344842034404704__ ready
script 2 started
FileManager.getAtomSetCollectionFromFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=R441393)
FileManager opening url https://webbook.nist.gov/cgi/cbook.cgi?Str3File=R441393
The Resolver thinks Mol
NIST 07071515273D 1 1.00000 -1836.86657
Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved.
copyright:"Collection (C) 2016 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved."
date:"2015-07-07"
webbook.id:"R441393"
method:"B3LYP/6-31G*"
dipole.moment:"1.3827 debye"
electronic.energy:"-1836.86657334 hartree"
ir.frequencies:"\"Frequency (cm-1)\" \"Intensity (km/mol)\"\n18.7246 0.0505\n25.9722 0.0956\n33.3922 0.4258\n38.3973 0.0994\n46.9950 0.2686\n50.0992 0.9427\n62.4825 0.4113\n64.6743 1.2872\n80.6695 0.4798\n106.7929 0.2541\n120.0298 0.4223\n124.2184 0.0185\n124.9643 0.6730\n135.4894 0.0101\n143.8920 0.3028\n145.7121 0.0290\n150.9672 0.0846\n154.0864 0.2497\n159.2388 0.1875\n163.0817 0.0374\n172.2626 0.0869\n176.8125 1.2357\n181.2199 0.1571\n186.4697 0.2133\n192.5944 0.3991\n197.8408 0.2318\n201.2042 0.4494\n203.0087 0.4135\n212.5335 0.1531\n220.8269 0.1481\n231.3113 0.3265\n245.1891 3.2515\n252.5006 2.7435\n265.9676 3.3207\n280.3894 1.6550\n287.4703 16.0001\n296.2459 12.4048\n320.4739 11.3043\n335.1740 12.5589\n394.5602 2.6109\n423.1255 5.4573\n429.9175 25.6330\n448.7958 1.8372\n535.0195 7.4974\n576.8608 10.4198\n595.4606 3.2363\n602.3530 0.7581\n624.3505 11.7305\n657.3287 4.1719\n684.3555 8.3875\n685.2891 4.4942\n685.4270 11.6195\n690.3082 8.1574\n690.4696 4.2795\n695.8857 4.6752\n696.3574 1.6205\n698.9435 0.7212\n701.8668 0.0636\n732.6250 13.2882\n755.5564 13.9853\n776.0616 41.1899\n779.6519 29.5044\n781.7926 4.6283\n783.8454 19.5310\n786.5589 12.4460\n790.8474 22.7076\n797.1025 24.8674\n817.6508 2.3585\n860.7034 16.8942\n869.2901 30.3726\n881.0286 91.6824\n882.7004 82.6385\n883.7784 25.0105\n887.9432 123.0083\n890.2963 108.9410\n892.2281 130.7802\n898.2688 143.3749\n909.7141 124.9819\n927.6220 208.6399\n934.3298 366.7460\n970.7234 114.0916\n997.4574 4.6397\n1005.7160 88.8261\n1035.3298 37.8037\n1044.1977 5.4597\n1081.6958 127.2828\n1104.0436 369.5091\n1125.6152 20.8510\n1140.7473 204.8333\n1159.6969 52.0191\n1184.5169 274.7081\n1227.8510 1.8301\n1262.0432 16.1991\n1291.4322 3.6510\n1300.1213 5.6171\n1323.9439 28.9791\n1324.9316 37.1030\n1326.5314 29.1108\n1327.4444 20.6292\n1328.6463 27.5362\n1331.0126 27.4165\n1331.8155 21.7410\n1334.5117 56.4209\n1336.6584 41.6183\n1339.6410 26.0575\n1346.6621 2.8849\n1358.5084 2.5669\n1374.6214 13.4551\n1396.7904 4.0032\n1408.3392 13.3459\n1415.7796 15.7311\n1449.4351 9.5821\n1482.8600 0.2860\n1484.0536 0.0197\n1484.4489 0.6008\n1489.5758 2.6843\n1490.5119 0.1607\n1491.3449 0.2810\n1492.3801 0.5845\n1493.2432 0.5532\n1494.8352 1.6918\n1495.4331 1.9232\n1496.4139 1.6842\n1498.6568 1.5658\n1499.9033 0.3610\n1501.5044 3.0630\n1502.2580 4.0154\n1509.3582 9.3612\n1512.6585 11.5164\n1515.1724 5.4631\n1541.9622 5.9805\n3033.3280 24.8441\n3039.6523 6.0044\n3039.8514 3.1110\n3040.1059 4.4240\n3043.4208 4.6678\n3044.5801 6.5603\n3044.6524 7.5765\n3046.0576 2.0644\n3046.5434 7.5233\n3046.8570 6.9111\n3053.5666 71.9059\n3065.9888 0.9860\n3078.6766 24.8992\n3107.9132 2.7717\n3108.1424 1.5841\n3108.6075 7.5634\n3109.8526 11.6199\n3110.2335 6.3096\n3112.3058 15.8770\n3113.0930 36.6702\n3113.1862 49.1111\n3116.6768 17.2872\n3117.5497 28.7353\n3117.7078 18.6850\n3118.9835 13.0903\n3124.1692 14.4650\n3128.3813 19.7462\n3128.8743 45.4610\n3134.5658 25.7054\n3135.6719 4.4598\n3137.9351 7.0179\n3138.3342 11.7369\n3144.6171 12.7841\n3167.7268 10.6094"
rotational.constants:"0.24714 GHz\n0.16975 GHz\n0.12966 GHz"
software:"Gaussian 09, Revision D.01"
contributor:"Yvonne Niyonzima"
Time for openFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=R441393): 277 ms
reading 57 atoms
ModelSet: haveSymmetry:false haveUnitcells:false haveFractionalCoord:false
1 model in this collection. Use getProperty "modelInfo" or getProperty "auxiliaryInfo" to inspect them.
Default Van der Waals type for model set to Babel
57 atoms created
ModelSet: not autobonding; use forceAutobond=true to force automatic bond creation
Time for creating model: 21 ms
Script completed
Jmol script terminated
__Exporter exportScale: 10
__Exporter exportScale: 10