Formula |
C31H27N7O |
IUPAC Name |
5-benzyl-2-ethyl-3-[(1s)-5-[2-(2h-tetrazol-5-yl)phenyl]-2,3-dihydro-1h-inden-1-yl]imidazo[4,5-c]pyridin-4-one |
Molecular Mass |
513.592 g·mol−1 |
Heat of Formation |
579.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.30 ± 1.08 D |
Volume |
608.99 Å 3 |
Surface Area |
468.64 Å 2 |
HOMO Energy |
-8.40 ± 0.55 eV |
LUMO Energy |
1.71 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
QAYQVTMHUMLSNG-MHZLTWQESA-N |
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Links |
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Elements |
H
C
O
N
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