Formula |
C17H14ClN3O |
IUPAC Name |
1-[[(2r,3r)-2-(4-chlorophenyl)-3-phenyl-oxiran-2-yl]methyl]-4-aza-1-azonia-2-azanidacyclopenta-3,5-diene |
Molecular Mass |
311.766 g·mol−1 |
Heat of Formation |
331.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.36 ± 1.08 D |
Volume |
370.18 Å 3 |
Surface Area |
302.22 Å 2 |
HOMO Energy |
-9.73 ± 0.55 eV |
LUMO Energy |
-0.45 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
YGLGKNIVFJHGIW-SJORKVTESA-N |
QR Code |
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Links |
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Elements |
H
C
N
O
Cl
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