Formula |
C23H19ClN4O |
IUPAC Name |
[2-chloro-4-(3-methylpyrazol-1-yl)phenyl]-(6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl)methanone |
Molecular Mass |
402.876 g·mol−1 |
Heat of Formation |
331.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.85 ± 1.08 D |
Volume |
450.12 Å 3 |
Surface Area |
372.53 Å 2 |
HOMO Energy |
-8.79 ± 0.55 eV |
LUMO Energy |
-0.93 ± eV |
Point Group Symmetry |
C1
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Synonyms
|
- [2-chloro-4-(3-methyl-1-pyrazolyl)phenyl]-(6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl)methanone
- vna-932
- vna932
- way-vna-932
|
InChIKey |
JXKQHDZUZGKDGO-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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Elements |
H
C
N
O
Cl
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