Formula |
C31H34N2O |
IUPAC Name |
n-ethyl-4-[phenyl-[(1r,5s)-8-(2-phenylethyl)-8-azabicyclo[3.2.1]octan-3-ylidene]methyl]benzamide |
Molecular Mass |
450.614 g·mol−1 |
Heat of Formation |
82.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.13 ± 1.08 D |
Volume |
583.15 Å 3 |
Surface Area |
488.19 Å 2 |
HOMO Energy |
-9.09 ± 0.55 eV |
LUMO Energy |
2.79 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- (
- )
- ,
- -
- .
- 1
- 2
- 3
- 4
- 5
- 8
- [
- ]
- a
- b
- c
- d
- e
- h
- i
- l
- m
- n
- o
- p
- r
- s
- t
- y
- z
|
InChIKey |
SMEALXDSTRDBRR-LNZIDBMMSA-N |
QR Code |
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Links |
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DOI |
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Downloads |
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Elements |
H
C
O
N
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