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__761511023437616__ initializing
Jmol getValue debug null
Jmol getValue logLevel null
Jmol getValue allowjavascript null
AppletRegistry.checkIn(MoleculeDisplay__761511023437616__)
vwrOptions:
{ "name":"MoleculeDisplay","applet":true,"documentBase":"https://webbook.nist.gov/cgi/inchi?Str3View=C116660505&Type=JSmol","platform":"J.awtjs.Platform","fullName":"MoleculeDisplay__761511023437616__","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":"761511023437616","bgcolor":"black" }
setting document base to "https://webbook.nist.gov/cgi/inchi?Str3View=C116660505&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__761511023437616__ ready
script 2 started
FileManager.getAtomSetCollectionFromFile(https://webbook.nist.gov/cgi/inchi?Str3File=C116660505)
FileManager opening url https://webbook.nist.gov/cgi/inchi?Str3File=C116660505
The Resolver thinks Mol
NIST 08061402033D 1 1.00000 -786.62049
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:"2014-08-06"
cas.number:"116660-50-5"
method:"B3LYP/6-31G*"
dipole.moment:"1.6877 debye"
electronic.energy:"-786.620492552 hartree"
ir.frequencies:"\"Frequency (cm-1)\" \"Intensity (km/mol)\"\n18.2706 0.0765\n25.1709 0.1610\n51.1899 0.5453\n55.6866 1.7533\n66.2037 0.0158\n79.3938 0.2190\n106.0764 0.0292\n138.0523 2.0884\n141.4771 0.5733\n147.7451 0.2407\n178.4391 0.4195\n207.0745 0.5769\n251.2423 0.0026\n261.5142 0.2191\n282.2450 7.6212\n298.5382 4.5307\n328.1500 7.0730\n368.3253 1.7197\n371.9876 0.8091\n424.6849 2.1226\n432.2573 10.9272\n446.7694 1.9428\n468.4530 5.4765\n511.2703 55.3708\n543.0262 5.9283\n571.0120 26.0065\n597.0407 27.3411\n609.6565 10.0022\n650.9773 10.8563\n666.9443 16.4099\n735.8470 0.4898\n741.7538 2.3824\n755.5858 8.1417\n768.2289 0.0531\n794.7761 0.8687\n803.2262 9.1509\n846.9362 0.3860\n854.4184 25.8168\n857.8048 0.4187\n865.2036 15.1201\n887.9031 5.6205\n913.1301 0.6956\n933.8341 3.0440\n958.0389 0.1262\n961.6391 2.2972\n963.7596 0.1669\n983.2120 0.2234\n1007.4670 23.3574\n1016.5265 0.9506\n1037.1998 2.2540\n1043.0658 1.9351\n1071.7730 0.1963\n1072.3179 6.8576\n1105.7477 0.4742\n1110.6873 1.8282\n1137.7045 7.8710\n1156.9690 5.3342\n1197.5543 32.8085\n1215.5155 3.5940\n1236.9969 2.8401\n1241.0512 0.3748\n1256.0095 20.2039\n1272.0040 32.4722\n1276.8818 1.4520\n1292.8698 37.3526\n1301.8792 1.2463\n1313.2872 51.1284\n1341.7670 0.8177\n1346.9362 2.3589\n1351.8749 1.9690\n1353.6412 49.0007\n1368.5969 3.3800\n1399.3689 3.3698\n1421.3534 0.5482\n1436.1617 8.6254\n1442.4847 0.6792\n1447.4538 55.9212\n1456.4093 325.8787\n1480.5209 68.8013\n1506.4127 10.7014\n1512.6241 5.3750\n1514.7475 0.1522\n1516.5065 0.3476\n1523.9261 1.7341\n1530.2344 5.9178\n1534.4419 47.3467\n1535.5735 0.6975\n1544.5697 4.0401\n1564.3025 193.2986\n1599.6456 94.1460\n1619.5281 4.5782\n1631.7214 5.3611\n1673.4435 23.6171\n3012.7353 9.0578\n3024.0969 4.9972\n3029.3488 12.2984\n3036.2608 6.4055\n3037.5512 80.0524\n3042.0176 56.2002\n3053.5640 2.2501\n3056.5992 14.2328\n3065.4096 10.2017\n3083.5636 65.7322\n3106.6115 67.1206\n3111.6166 44.0454\n3112.0961 8.8776\n3155.6284 11.0145\n3175.1835 19.5923\n3175.8738 10.2467\n3176.4259 17.2811\n3195.9057 19.1392\n3196.6901 55.0600\n3205.1627 7.9493\n3549.9660 28.3614"
rotational.constants:"1.17469 GHz\n0.11183 GHz\n0.11156 GHz"
software:"Gaussian 09, Revision D.01"
contributor:"Ethan Ho"
Time for openFile(https://webbook.nist.gov/cgi/inchi?Str3File=C116660505): 378 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: 9 ms
Script completed
Jmol script terminated
__Exporter exportScale: 10
__Exporter exportScale: 10