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__491915398034384__ initializing
Jmol getValue debug null
Jmol getValue logLevel null
Jmol getValue allowjavascript null
AppletRegistry.checkIn(MoleculeDisplay__491915398034384__)
vwrOptions:
{ "name":"MoleculeDisplay","applet":true,"documentBase":"https://webbook.nist.gov/cgi/inchi?Str3View=C481345&Type=JSmol","platform":"J.awtjs.Platform","fullName":"MoleculeDisplay__491915398034384__","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":"491915398034384","bgcolor":"black" }
setting document base to "https://webbook.nist.gov/cgi/inchi?Str3View=C481345&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__491915398034384__ ready
script 2 started
FileManager.getAtomSetCollectionFromFile(https://webbook.nist.gov/cgi/inchi?Str3File=C481345)
FileManager opening url https://webbook.nist.gov/cgi/inchi?Str3File=C481345
The Resolver thinks Mol
NIST 08031215113D 1 1.00000 -662.47388
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:"481-34-5"
method:"B3LYP/6-31G*"
dipole.moment:"1.5106 debye"
electronic.energy:"-662.473879479 hartree"
ir.frequencies:"\"Frequency (cm-1)\" \"Intensity (km/mol)\"\n43.2597 0.0705\n77.3759 0.2680\n90.9466 0.0473\n123.4994 0.2229\n154.3708 0.4609\n185.8783 0.6581\n197.3740 0.0675\n215.9617 0.2742\n226.5615 2.2639\n238.4617 0.1652\n253.0724 0.0849\n263.8246 13.1714\n290.2058 3.1014\n298.0198 13.4238\n305.2412 87.1664\n312.0017 7.2462\n322.4541 2.1156\n358.0254 1.2420\n385.3937 4.8105\n392.6152 0.4464\n431.8211 0.8871\n435.5986 0.9264\n449.3714 0.6855\n462.0920 1.3801\n486.6220 9.1935\n517.3330 3.9870\n552.9711 0.5687\n566.3239 0.2368\n585.2531 5.2839\n653.5281 0.8943\n767.4981 0.0859\n794.9383 0.4355\n828.4147 1.4858\n846.8470 4.7220\n858.2270 1.2328\n895.0637 5.8557\n928.6232 3.9526\n932.7323 7.9365\n941.0203 3.8454\n952.6335 2.2125\n961.0484 17.4569\n973.5292 0.6195\n989.1758 3.2905\n998.8291 3.7812\n1017.8419 5.9763\n1036.9181 6.0320\n1044.5920 3.3021\n1060.0669 0.6919\n1064.8924 6.6278\n1084.1724 6.7228\n1104.9689 4.5779\n1112.6253 20.9557\n1124.4598 3.7468\n1141.6407 42.5595\n1160.0303 26.1979\n1164.6386 8.9662\n1184.7668 7.2013\n1187.2491 10.3279\n1210.6350 3.4551\n1218.7580 0.9250\n1238.3050 10.6568\n1276.5660 2.6308\n1289.9797 3.0016\n1302.2653 5.1194\n1317.7458 13.1013\n1336.4802 4.5856\n1339.8268 8.1729\n1356.1405 0.7438\n1367.1114 6.3167\n1371.6042 5.7848\n1377.1011 13.2704\n1385.0624 4.6608\n1399.4693 2.5267\n1403.1463 0.1380\n1407.1572 0.3786\n1420.5553 3.1562\n1426.7469 7.5806\n1430.5377 1.8864\n1439.1136 20.2362\n1442.3454 2.1178\n1450.8898 4.9430\n1505.4659 4.4929\n1509.9699 0.8727\n1510.1410 5.1685\n1517.0964 5.4210\n1518.5946 2.3485\n1522.2830 7.3894\n1524.1404 1.8182\n1525.5653 0.7932\n1530.7462 2.8033\n1535.1608 3.3443\n1538.6980 1.7265\n1547.3968 4.3550\n1743.8216 2.4844\n2956.8843 16.6144\n2997.1862 4.0014\n3004.4967 25.0908\n3010.5528 9.0894\n3013.3635 33.3626\n3023.3757 48.6823\n3028.2592 31.5334\n3031.0887 20.1575\n3039.1031 26.4746\n3041.9498 54.0131\n3043.0756 42.8190\n3046.4055 34.8269\n3050.6959 24.3680\n3066.3752 24.6127\n3071.5171 56.3360\n3082.7049 45.3438\n3090.3627 38.8038\n3097.3370 5.5902\n3106.0538 75.3160\n3112.0758 27.4552\n3118.7738 23.3531\n3124.3511 37.4951\n3127.1873 43.2528\n3132.0216 29.8182\n3177.4318 26.3000\n3742.8616 3.7981"
rotational.constants:"0.54021 GHz\n0.50515 GHz\n0.28817 GHz"
software:"Gaussian 09, Revision C.01"
contributor:"Alexander Yang"
Time for openFile(https://webbook.nist.gov/cgi/inchi?Str3File=C481345): 181 ms
reading 42 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
42 atoms created
ModelSet: not autobonding; use forceAutobond=true to force automatic bond creation
Time for creating model: 12 ms
Script completed
Jmol script terminated
__Exporter exportScale: 10
__Exporter exportScale: 10