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__4755016945977597__ initializing
Jmol getValue debug null
Jmol getValue logLevel null
Jmol getValue allowjavascript null
AppletRegistry.checkIn(MoleculeDisplay__4755016945977597__)
vwrOptions:
{ "name":"MoleculeDisplay","applet":true,"documentBase":"https://webbook.nist.gov/cgi/inchi?Str3View=C303480&Type=JSmol","platform":"J.awtjs.Platform","fullName":"MoleculeDisplay__4755016945977597__","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":"4755016945977597","bgcolor":"black" }
setting document base to "https://webbook.nist.gov/cgi/inchi?Str3View=C303480&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__4755016945977597__ ready
script 2 started
FileManager.getAtomSetCollectionFromFile(https://webbook.nist.gov/cgi/inchi?Str3File=C303480)
FileManager opening url https://webbook.nist.gov/cgi/inchi?Str3File=C303480
The Resolver thinks Mol
NIST 08031215053D 1 1.00000 -1268.24697
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:"303-48-0"
method:"B3LYP/6-31G*"
dipole.moment:"2.7205 debye"
electronic.energy:"-1268.24697144 hartree"
ir.frequencies:"\"Frequency (cm-1)\" \"Intensity (km/mol)\"\n18.3139 0.0993\n34.7110 0.1290\n46.2593 0.6274\n56.6959 1.7842\n68.3045 0.6838\n91.1687 1.6189\n117.7658 0.1463\n128.1811 0.1108\n144.3705 1.4617\n149.2720 0.4462\n201.9192 0.5578\n207.7873 0.8528\n230.4185 1.5556\n260.7378 0.9970\n269.9230 0.6693\n302.2858 2.5894\n312.7015 1.0955\n326.4527 1.9051\n346.1742 1.7975\n365.2708 5.5823\n392.5357 0.7804\n419.4809 1.2218\n451.9561 3.4032\n472.7067 4.1853\n485.0966 0.5237\n506.2688 4.2226\n535.9050 4.8571\n567.2557 1.0449\n601.0259 5.2457\n629.2836 3.9744\n643.0484 4.8503\n659.6239 14.5467\n707.9895 0.1779\n731.6301 4.8449\n756.4197 9.0748\n765.1423 20.7776\n776.3887 6.9859\n784.7794 9.4354\n797.9206 86.7139\n826.5774 3.1511\n833.2015 22.8217\n867.6731 6.2324\n869.9188 25.6422\n904.0605 5.9352\n922.8856 4.7438\n938.2614 0.8934\n949.7793 5.9899\n959.2289 34.6546\n970.9659 0.7593\n979.3553 1.1617\n980.4044 0.9133\n1039.0706 12.2828\n1051.4660 9.1069\n1057.4881 1.0090\n1076.7105 22.0208\n1090.1341 17.6810\n1111.7374 45.4726\n1117.9029 6.0207\n1145.5623 18.2485\n1154.6373 51.2047\n1157.4889 0.9343\n1184.0303 8.9832\n1195.7079 7.5052\n1196.8424 11.0067\n1199.0336 11.9591\n1208.7337 3.6329\n1228.9232 13.4505\n1249.2923 39.9398\n1255.4519 20.3804\n1262.9257 42.6084\n1294.2725 14.3999\n1313.4516 1.1079\n1315.5170 27.5481\n1326.2203 16.3617\n1335.8436 11.5074\n1337.6994 11.0278\n1353.2376 9.4420\n1376.9091 5.8525\n1396.0311 16.1025\n1404.5304 2.1725\n1416.1285 1.0167\n1431.4671 68.9935\n1453.2766 17.7787\n1486.1218 0.6997\n1493.1424 39.2593\n1507.8289 24.2594\n1508.8557 16.3795\n1509.7265 4.4152\n1513.8871 4.9683\n1520.3946 10.0002\n1528.6392 5.4062\n1531.1583 165.7692\n1542.7414 46.4201\n1544.5943 18.3092\n1553.3616 0.6537\n1620.9407 15.2821\n1627.9458 20.9628\n1643.7391 48.0575\n1660.3486 14.3215\n2908.0363 69.2490\n2949.8651 116.6021\n3010.8179 26.9715\n3021.6661 23.3257\n3033.1739 1.4080\n3045.9868 0.2991\n3046.3579 79.4818\n3064.7296 48.4286\n3072.8321 45.4995\n3086.8544 5.2027\n3092.3767 28.4816\n3111.1062 44.8872\n3120.0473 34.5906\n3167.9276 14.1240\n3184.8535 14.6375\n3185.6786 8.8017\n3204.6697 35.8695\n3215.9842 15.8095\n3225.6664 4.7693\n3244.4706 1.0543\n3479.7980 1.4298"
rotational.constants:"0.24403 GHz\n0.23001 GHz\n0.13711 GHz"
software:"Gaussian 09, Revision C.01"
contributor:"Alexander Yang"
Time for openFile(https://webbook.nist.gov/cgi/inchi?Str3File=C303480): 149 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: 9 ms
Script completed
Jmol script terminated
__Exporter exportScale: 10
__Exporter exportScale: 10