Geometry & MOs

Info

ID:	38941
PubChem CID:	8138204
Reduced:	FSN4O4H17C19 (1)
Stoich.:	ABC4D4E17F19 (1)
Weight, g/mol:	320.067618
ΔH_f, kcal/mol:	-112.97
Dipole, Da:	6.78
IP(EA), eV:	-9.19(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[2-oxo-2-[2-(1H-pyrrole-2-carbonyl)hydrazinyl]ethyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=CC(=C2)C(=O)NNC(=O)C3=CC=CN3)F

DOS

IR

Vibrations