Geometry & MOs

Info

ID:	35407
PubChem CID:	7979817
Reduced:	ClN2O4H13C17 (1)
Stoich.:	AB2C4D13E17 (1)
Weight, g/mol:	362.093643
ΔH_f, kcal/mol:	-26.2
Dipole, Da:	5.12
IP(EA), eV:	-8.96(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethoxy-N'-(4-oxo-4-thiophen-2-ylbutanoyl)benzohydrazide

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2N1)C(=O)COC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

DOS

IR

Vibrations