Geometry & MOs

Info

ID:	39023
PubChem CID:	8138380
Reduced:	OSN3H17C19 (1)
Stoich.:	ABC3D17E19 (1)
Weight, g/mol:	350.104876
ΔH_f, kcal/mol:	57.01
Dipole, Da:	2.34
IP(EA), eV:	-9.25(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylphenyl)-N-[2-oxo-2-[2-(1H-pyrrole-2-carbonyl)hydrazinyl]ethyl]methanesulfonamide

Drug info:

PubChemData

Smile

C1CC1NC(=O)[C@H](C2=CC=CC=C2)SC3=NC=NC4=CC=CC=C43

DOS

IR

Vibrations