Geometry & MOs

Info

ID:	236347
PubChem CID:	92712463
Reduced:	SN3O4C21H23 (1)
Stoich.:	AB3C4D21E23 (1)
Weight, g/mol:	413.140927
ΔH_f, kcal/mol:	-125.97
Dipole, Da:	3.48
IP(EA), eV:	-8.7(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-4-methyl-2-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]-N-phenylpentanamide

Drug info:

PubChemData

Smile

CC(C)C[C@H](C(=O)NC1=CC=CC=C1)NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3

DOS

IR

Vibrations