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__391457025756923__ initializing
Jmol getValue debug null
Jmol getValue logLevel null
Jmol getValue allowjavascript null
AppletRegistry.checkIn(MoleculeDisplay__391457025756923__)
vwrOptions:
{ "name":"MoleculeDisplay","applet":true,"documentBase":"https://webbook.nist.gov/cgi/inchi?Str3View=R313085&Type=JSmol","platform":"J.awtjs.Platform","fullName":"MoleculeDisplay__391457025756923__","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":"391457025756923","bgcolor":"black" }
setting document base to "https://webbook.nist.gov/cgi/inchi?Str3View=R313085&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__391457025756923__ ready
script 2 started
FileManager.getAtomSetCollectionFromFile(https://webbook.nist.gov/cgi/inchi?Str3File=R313085)
FileManager opening url https://webbook.nist.gov/cgi/inchi?Str3File=R313085
The Resolver thinks Mol
NIST 07061516083D 1 1.00000 -1659.88966
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:"2015-07-06"
webbook.id:"R313085"
method:"B3LYP/6-31G*"
dipole.moment:"3.3315 debye"
electronic.energy:"-1659.88965616 hartree"
ir.frequencies:"\"Frequency (cm-1)\" \"Intensity (km/mol)\"\n15.0752 0.3937\n20.8642 0.3236\n28.1479 0.1530\n36.1093 0.6732\n47.3210 0.7064\n55.1665 0.1295\n72.1244 0.1772\n75.5576 2.2198\n80.0098 4.2058\n101.7730 0.3159\n130.4170 2.5174\n140.0858 3.9328\n154.1458 2.9408\n168.2898 0.3656\n200.9920 0.0234\n216.6737 0.6468\n233.6144 2.0732\n270.0367 0.8266\n290.5952 2.1797\n314.5499 0.5508\n355.4791 1.6651\n358.9755 10.7240\n374.6573 1.0593\n389.1657 2.9112\n403.5481 2.6763\n418.5806 0.1787\n435.4148 3.3453\n447.3606 1.0997\n471.8859 18.1036\n484.1983 7.2250\n525.7441 4.4182\n531.5887 0.5616\n548.7193 1.7110\n579.8687 7.8898\n598.2870 12.4223\n608.5899 27.3180\n629.1189 3.3486\n632.5942 0.6790\n662.6989 34.0482\n681.0395 13.0279\n704.6459 11.9964\n708.3634 7.1072\n733.0372 41.5256\n772.9058 1.3698\n779.0266 5.8954\n804.7560 26.4005\n824.4931 11.0048\n838.8550 9.8054\n858.6117 2.2409\n868.9867 1.7140\n899.5192 17.3624\n910.7503 9.6827\n952.2401 15.7150\n960.3719 4.8034\n964.0801 48.4785\n986.0196 3.1766\n1008.2712 90.7734\n1010.0309 0.9186\n1018.1488 2.0935\n1042.8940 35.3787\n1046.9115 0.7872\n1056.4563 1.2331\n1061.6921 9.5786\n1115.0377 5.7119\n1118.4706 22.1060\n1135.2976 29.4670\n1162.5798 45.0761\n1181.5623 5.7574\n1183.7637 23.2612\n1195.6381 1.7803\n1198.4452 181.6811\n1211.9890 28.9513\n1273.9655 152.0419\n1279.5319 69.0059\n1280.5371 442.9306\n1288.9889 126.3534\n1311.2919 15.3968\n1332.7443 61.5492\n1349.1093 19.3059\n1350.4958 12.4504\n1368.9113 3.1204\n1372.5343 70.3541\n1402.8760 59.6168\n1428.3122 69.5240\n1429.1557 94.7295\n1444.0532 81.7877\n1494.2269 16.9006\n1497.3389 8.6163\n1509.8638 14.3071\n1520.4317 11.8367\n1522.5028 92.1814\n1537.3510 4.2241\n1538.8326 1.7578\n1611.0518 21.5447\n1636.1154 7.3771\n1642.1212 3.7313\n1656.5601 29.2779\n1745.9458 168.0618\n1784.2161 243.6768\n3059.9365 6.0771\n3083.4240 2.9885\n3106.2667 12.5394\n3121.7853 9.6318\n3129.1686 6.0964\n3168.0947 13.7591\n3178.4800 6.0194\n3188.7612 0.2189\n3199.2993 8.9219\n3208.7370 27.4243\n3218.0428 9.2629\n3220.9202 3.2306\n3226.1333 6.6859\n3229.4317 0.7276\n3234.5251 2.8597"
rotational.constants:"0.19596 GHz\n0.15151 GHz\n0.11812 GHz"
software:"Gaussian 09, Revision D.01"
contributor:"Yvonne Niyonzima"
Time for openFile(https://webbook.nist.gov/cgi/inchi?Str3File=R313085): 300 ms
reading 40 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
40 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