7-Chloro-8A-Isocyano-5,5,8,11,11-Pentamethyl-8-Vinyl-1,5,5A,6,7,8,8A,11-Octahydro-8Bh-1-Azacyclohepta[Mno]Aceanthrylen-8B-Ol

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Formula C26H48ClN2O
IUPAC Name (2s)-1-chloropropan-2-olate; ethylene; hydron; methane; (e)-1-[1-[(1z,3e)-7-(2-methylcyclobuten-1-yl)hepta-1,3-dienyl]cyclopropyl]ethylidene-[(e)-prop-1-enyl]ammonium; nitrogen
Molecular Mass 449.197 g·mol−1
Heat of Formation 119.3 ± 16.7 kJ·mol−1
Dipole Moment 6.20 ± 1.08 D
Volume 503.75 Å 3
Surface Area 368.59 Å 2
HOMO Energy -8.50 ± 0.55 eV
LUMO Energy -0.09 ± eV
Point Group Symmetry C1
InChIKey RSUTYZFOFIAHFY-XFVVUKIPSA-N
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Elements H C N O Cl