Geometry & MOs

Info

ID:	35427
PubChem CID:	7979846
Reduced:	ClN2O4C17H17 (1)
Stoich.:	AB2C4D17E17 (1)
Weight, g/mol:	368.100836
ΔH_f, kcal/mol:	-40.44
Dipole, Da:	5.8
IP(EA), eV:	-8.9(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(3,5-dimethoxybenzoyl)-2-oxochromene-3-carbohydrazide

Drug info:

PubChemData

Smile

CC1=CC(=C(N1CC=C)C)C(=O)COC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

DOS

IR

Vibrations