Formula |
C28H34N4O2 |
IUPAC Name |
2-amino-n,n-dipropyl-8-[4-(pyrrolidine-1-carbonyl)phenyl]-3h-1-benzazepine-4-carboxamide |
Molecular Mass |
458.595 g·mol−1 |
Heat of Formation |
-176.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.64 ± 1.08 D |
Volume |
581.26 Å 3 |
Surface Area |
493.65 Å 2 |
HOMO Energy |
-8.72 ± 0.55 eV |
LUMO Energy |
-0.71 ± eV |
Point Group Symmetry |
C1
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Synonyms
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- 2-amino-8-[4-(oxo-1-pyrrolidinylmethyl)phenyl]-n,n-dipropyl-3h-1-benzazepine-4-carboxamide
- 2-amino-n,n-dipropyl-8-(4-pyrrolidin-1-ylcarbonylphenyl)-3h-1-benzazepine-4-carboxamide
- 2-amino-n,n-dipropyl-8-[4-(pyrrolidine-1-carbonyl)phenyl]-3h-1-benzazepine-4-carboxamide
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InChIKey |
QSPOQCXMGPDIHI-UHFFFAOYSA-N |
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Links |
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Downloads |
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Elements |
H
C
O
N
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