Geometry & MOs

Info

ID:	62297
PubChem CID:	26719042
Reduced:	O5N6C21H24 (1)
Stoich.:	A5B6C21D24 (1)
Weight, g/mol:	376.153541
ΔH_f, kcal/mol:	-55.56
Dipole, Da:	4.04
IP(EA), eV:	-9.16(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(2H-chromene-3-carbonyl)-1-ethyl-2-methylbenzimidazole-5-carbohydrazide

Drug info:

PubChemData

Smile

CCN1C(=NC2=C1C=CC(=C2)C(=O)NNC(=O)C3=CC(=C(C=C3)NCCOC)[N+](=O)[O-])C

DOS

IR

Vibrations