Formula |
C19H14Cl2N2O5 |
IUPAC Name |
4-[[(3s)-7-chloro-5-(2-chlorophenyl)-2-oxo-1,3-dihydro-1,4-benzodiazepin-3-yl]oxy]-4-oxo-butanoic acid |
Molecular Mass |
421.231 g·mol−1 |
Heat of Formation |
-696.1 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.34 ± 1.08 D |
Volume |
444.41 Å 3 |
Surface Area |
386.08 Å 2 |
HOMO Energy |
-9.46 ± 0.55 eV |
LUMO Energy |
-1.15 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
NFXVKMXGODLOOD-IBGZPJMESA-N |
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Elements |
H
C
N
O
Cl
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