Geometry & MOs

Info

ID:	235407
PubChem CID:	92708555
Reduced:	SN3O4H25C26 (1)
Stoich.:	AB3C4D25E26 (1)
Weight, g/mol:	488.151826
ΔH_f, kcal/mol:	-65.15
Dipole, Da:	7.57
IP(EA), eV:	-8.69(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(4-acetamidophenyl)-3-phenyl-2-(quinolin-8-ylsulfonylamino)propanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)NC(=O)[C@H](CC2=CC=CC=C2)NS(=O)(=O)C3=CC=CC4=C3N=CC=C4

DOS

IR

Vibrations