Geometry & MOs

Info

ID:	236345
PubChem CID:	92712460
Reduced:	SN3O4C22H25 (1)
Stoich.:	AB3C4D22E25 (1)
Weight, g/mol:	427.156577
ΔH_f, kcal/mol:	-135.23
Dipole, Da:	4.01
IP(EA), eV:	-8.82(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-4-methyl-N-(3-methylphenyl)-2-[(2-oxo-1H-quinolin-6-yl)sulfonylamino]pentanamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)[C@H](CC(C)C)NS(=O)(=O)C2=CC3=C(C=C2)NC(=O)C=C3

DOS

IR

Vibrations