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__5345191570265264__ initializing
Jmol getValue debug null
Jmol getValue logLevel null
Jmol getValue allowjavascript null
AppletRegistry.checkIn(MoleculeDisplay__5345191570265264__)
vwrOptions:
{ "name":"MoleculeDisplay","applet":true,"documentBase":"https://webbook.nist.gov/cgi/cbook.cgi?Str3View=C627758&Type=JSmol","platform":"J.awtjs.Platform","fullName":"MoleculeDisplay__5345191570265264__","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":"5345191570265264","bgcolor":"black" }
setting document base to "https://webbook.nist.gov/cgi/cbook.cgi?Str3View=C627758&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__5345191570265264__ ready
script 2 started
FileManager.getAtomSetCollectionFromFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C627758)
FileManager opening url https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C627758
The Resolver thinks Mol
NIST 08031214543D 1 1.00000 -1067.33079
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:"2012-08-03"
cas.number:"627-75-8"
method:"B3LYP/6-31G*"
dipole.moment:"5.6107 debye"
electronic.energy:"-1067.33078785 hartree"
ir.frequencies:"\"Frequency (cm-1)\" \"Intensity (km/mol)\"\n16.6701 3.7870\n23.2933 2.6416\n31.0892 3.1171\n41.7048 3.1561\n50.4023 6.6217\n71.0805 5.6802\n90.2110 1.7978\n110.2025 3.2296\n133.2436 2.6438\n166.6370 7.6625\n194.5134 2.9711\n247.1833 1.2673\n278.9007 18.9937\n282.8988 32.5428\n313.0672 18.3906\n376.3167 20.9224\n384.5584 7.0953\n447.1919 50.2898\n468.3121 81.2979\n524.1159 33.4470\n547.2333 53.1496\n556.7936 9.7081\n563.0390 240.5960\n582.2268 39.4421\n607.6319 26.0316\n649.9934 37.2260\n714.5037 39.6540\n735.8665 7.8856\n765.3277 3.9486\n789.3855 70.4845\n819.6893 4.5697\n895.0232 46.5844\n903.2089 94.6680\n951.9265 92.4239\n975.9350 6.1238\n1045.1715 53.9263\n1057.2685 4.1053\n1067.8252 5.4579\n1094.8225 13.7508\n1097.0967 14.6170\n1142.5253 17.2271\n1160.7799 84.7585\n1171.2751 59.1962\n1192.7026 4.7798\n1224.7114 24.8232\n1262.9262 9.2863\n1290.4113 1.9667\n1308.1835 2.8208\n1331.6533 1.5987\n1357.9911 12.6876\n1376.7446 64.2396\n1404.1606 43.8677\n1420.2123 9.2347\n1438.2674 29.0768\n1473.8649 465.8963\n1518.1834 1.7607\n1531.4804 0.2792\n1548.7498 6.0999\n1560.6033 211.2678\n1680.5320 83.3878\n1693.6639 27.1228\n1730.8796 247.7542\n1822.1691 517.1934\n2568.9738 1331.6459\n2997.0484 39.2971\n3027.5105 15.2411\n3046.4102 29.0020\n3052.6009 6.5167\n3069.4647 29.4146\n3104.6469 5.8746\n3126.3549 21.8632\n3290.0540 331.7550\n3470.6219 7.5791\n3486.8479 1.4296\n3553.9708 7.6614\n3562.7702 5.8980\n3579.3435 8.4062\n3662.9317 13.0322"
rotational.constants:"0.73970 GHz\n0.22103 GHz\n0.17431 GHz"
software:"Gaussian 09, Revision C.01"
contributor:"Jeffrey Qiu"
Time for openFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C627758): 53 ms
reading 28 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
28 atoms created
ModelSet: not autobonding; use forceAutobond=true to force automatic bond creation
Time for creating model: 8 ms
Script completed
Jmol script terminated
__Exporter exportScale: 10
__Exporter exportScale: 10