Geometry & MOs

Info

ID:	31940
PubChem CID:	3724270
Reduced:	N2O3H16C23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	409.049715
ΔH_f, kcal/mol:	68.07
Dipole, Da:	0.93
IP(EA), eV:	-9.24(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(2,5-dichlorophenyl)hydrazinyl]methylidene]-3-methyl-1-oxopyrido[1,2-a]benzimidazole-4-carbonitrile

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=C(N2C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4)C=O

DOS

IR

Vibrations