Geometry & MOs

Info

ID:	182220
PubChem CID:	76861680
Reduced:	O3N5H17C20 (1)
Stoich.:	A3B5C17D20 (1)
Weight, g/mol:	384.179755
ΔH_f, kcal/mol:	-8.96
Dipole, Da:	3.43
IP(EA), eV:	-8.73(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methyl-N'-(3-methyl-1-benzofuran-2-carbonyl)-4-oxo-2,3,4a,5,6,7,8,8a-octahydro-1H-1,8-naphthyridine-3-carbohydrazide

Drug info:

PubChemData

Smile

CC1=NC2=C(C=C1)C(=O)C(C=N2)C(=O)NNC(=O)CC3=CNC4=CC=CC=C43

DOS

IR

Vibrations