Formula |
C21H25N3O |
IUPAC Name |
(4-aminophenyl)-[(1r,5s)-7-benzyl-3,7-diazabicyclo[3.3.1]nonan-3-yl]methanone |
Molecular Mass |
335.443 g·mol−1 |
Heat of Formation |
20.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.77 ± 1.08 D |
Volume |
415.93 Å 3 |
Surface Area |
332.63 Å 2 |
HOMO Energy |
-8.49 ± 0.55 eV |
LUMO Energy |
0.28 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (4-aminophenyl)-[(1r,5s)-7-(benzyl)-3,7-diazabicyclo[3.3.1]nonan-3-yl]methanone
- (4-aminophenyl)-[(1r,5s)-7-(phenylmethyl)-3,7-diazabicyclo[3.3.1]nonan-3-yl]methanone
|
InChIKey |
DLNAKYFPFYUBDR-HDICACEKSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
O
N
|
|
|