Formula |
C23H25ClN2O |
IUPAC Name |
3-(4-chlorophenyl)-n-(4-pyridylmethyl)adamantane-1-carboxamide |
Molecular Mass |
380.910 g·mol−1 |
Heat of Formation |
-89.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.77 ± 1.08 D |
Volume |
452.44 Å 3 |
Surface Area |
382.69 Å 2 |
HOMO Energy |
-9.48 ± 0.55 eV |
LUMO Energy |
2.48 ± eV |
Point Group Symmetry |
Cs
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Synonyms
|
- (5s,7r)-3-(4-chlorophenyl)-n-(4-pyridylmethyl)-1-adamantanecarboxamide
- (5s,7r)-3-(4-chlorophenyl)-n-(4-pyridylmethyl)adamantane-1-carboxamide
- (5s,7r)-3-(4-chlorophenyl)-n-(pyridin-4-ylmethyl)adamantane-1-carboxamide
|
InChIKey |
CAOTVXGYTWCKQE-BRNYJPRKSA-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
N
O
Cl
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