Formula |
C26H26N4O6 |
IUPAC Name |
9-(3-methoxy-4-nitro-phenyl)-1-(2-morpholinoethoxy)-5,11-dihydrobenzo[b][1,4]benzodiazepin-6-one |
Molecular Mass |
490.508 g·mol−1 |
Heat of Formation |
-347.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
8.96 ± 1.08 D |
Volume |
558.22 Å 3 |
Surface Area |
439.95 Å 2 |
HOMO Energy |
-8.48 ± 0.55 eV |
LUMO Energy |
1.84 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
FNAOLRABVJJTRC-UHFFFAOYSA-N |
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Elements |
H
C
O
N
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