Geometry & MOs

Info

ID:	60636
PubChem CID:	26697321
Reduced:	SN2O2C18H26 (1)
Stoich.:	AB2C2D18E26 (1)
Weight, g/mol:	424.04489
ΔH_f, kcal/mol:	-96.38
Dipole, Da:	3.02
IP(EA), eV:	-8.65(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-cyclopentyl-2-[(3,4-dichlorophenyl)sulfonylamino]-4-methylsulfanylbutanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(=O)N[C@@H](CCSC)C(=O)NC2CCCC2

DOS

IR

Vibrations