Geometry & MOs

Info

ID:	235405
PubChem CID:	92708529
Reduced:	ClSN3O3H22C25 (1)
Stoich.:	ABC3D3E22F25 (1)
Weight, g/mol:	483.081969
ΔH_f, kcal/mol:	-36.4
Dipole, Da:	7.1
IP(EA), eV:	-8.64(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations