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__5613796262841015__ initializing
Jmol getValue debug null
Jmol getValue logLevel null
Jmol getValue allowjavascript null
AppletRegistry.checkIn(MoleculeDisplay__5613796262841015__)
vwrOptions:
{ "name":"MoleculeDisplay","applet":true,"documentBase":"https://webbook.nist.gov/cgi/cbook.cgi?Str3View=C102850668&Type=JSmol","platform":"J.awtjs.Platform","fullName":"MoleculeDisplay__5613796262841015__","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":"5613796262841015","bgcolor":"black" }
setting document base to "https://webbook.nist.gov/cgi/cbook.cgi?Str3View=C102850668&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__5613796262841015__ ready
script 2 started
FileManager.getAtomSetCollectionFromFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C102850668)
FileManager opening url https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C102850668
The Resolver thinks Mol
NIST 07091519503D 1 1.00000 -995.85007
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:"2015-07-09"
cas.number:"102850-66-8"
method:"B3LYP/6-31G*"
dipole.moment:"6.1380 debye"
electronic.energy:"-995.850071798 hartree"
ir.frequencies:"\"Frequency (cm-1)\" \"Intensity (km/mol)\"\n29.6332 1.6464\n35.8523 3.5134\n45.3066 2.9774\n58.6804 4.1413\n60.4652 1.2021\n63.9881 0.4993\n83.1301 2.8484\n85.9020 1.1285\n91.4163 2.0905\n107.0772 1.2448\n138.9145 0.7955\n152.5048 0.4309\n171.0172 0.5325\n198.3131 0.5894\n214.0036 2.1049\n224.6333 0.0703\n233.3630 2.6553\n244.8911 2.3340\n273.4623 6.7703\n314.6400 8.5951\n327.8791 5.4500\n339.8886 0.6761\n347.7365 5.8518\n386.5280 0.6064\n418.5514 4.5303\n472.6165 7.0467\n484.0423 5.8195\n499.7791 17.2223\n518.7548 11.4935\n560.2572 22.5795\n570.0290 5.9314\n603.3843 8.9960\n630.8838 3.4250\n655.4655 5.2610\n691.8637 16.8146\n769.4927 20.0603\n825.1321 4.1344\n857.9069 5.5457\n862.0556 13.7130\n906.0004 1.6064\n939.3328 15.6902\n972.6079 22.3404\n989.4498 6.5793\n990.3323 9.3465\n1006.6960 0.6906\n1038.5464 60.1293\n1056.4157 8.7472\n1063.9540 96.6335\n1074.6425 33.1249\n1075.8879 14.2125\n1078.3610 67.1009\n1099.7006 10.8356\n1134.3453 17.4557\n1144.8756 101.7549\n1151.4204 81.1292\n1169.7095 154.3119\n1186.6784 16.1192\n1188.9455 2.5652\n1195.1834 56.9863\n1233.3569 8.8513\n1234.3872 37.2709\n1264.3727 500.6140\n1271.0847 169.6258\n1282.4102 32.0282\n1302.0505 48.5283\n1327.6956 16.5326\n1339.7999 8.2145\n1351.5723 25.3537\n1374.2445 12.4807\n1387.4299 2.3304\n1411.7998 23.7103\n1414.3055 45.5085\n1421.5175 9.0370\n1426.0389 25.8125\n1428.0972 28.8152\n1435.2637 49.3593\n1450.3381 3.6282\n1499.3616 14.7359\n1499.5988 3.4728\n1504.2448 7.8180\n1504.7642 1.9345\n1510.2007 8.3931\n1515.2012 3.3714\n1517.9888 1.7797\n1520.0221 3.6563\n1522.2302 12.8552\n1524.1107 3.2420\n1536.2574 13.2661\n1541.1253 5.7887\n1818.0477 197.9511\n1850.3996 327.6612\n2991.7209 41.1752\n2996.4914 22.5865\n3000.3080 52.9733\n3010.1014 37.8889\n3024.7203 70.0192\n3063.7287 2.6274\n3073.1948 1.5209\n3080.0769 41.7456\n3086.4533 34.8026\n3103.6566 16.7597\n3104.5718 36.0975\n3106.5745 22.1974\n3130.0605 20.6857\n3135.6829 4.3345\n3139.5798 4.6235\n3144.0085 20.3177\n3144.9271 33.0699\n3162.3213 12.8689\n3183.5710 6.3914\n3185.5213 6.0693"
rotational.constants:"0.65845 GHz\n0.23864 GHz\n0.22068 GHz"
software:"Gaussian 09, Revision D.01"
contributor:"Avi Newman"
Time for openFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C102850668): 407 ms
reading 39 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
39 atoms created
ModelSet: not autobonding; use forceAutobond=true to force automatic bond creation
Time for creating model: 7 ms
Script completed
Jmol script terminated
__Exporter exportScale: 10
__Exporter exportScale: 10