Geometry & MOs

Info

ID:	60630
PubChem CID:	26697314
Reduced:	BrN2S2O3C16H23 (1)
Stoich.:	AB2C2D3E16F23 (1)
Weight, g/mol:	434.03335
ΔH_f, kcal/mol:	-114.99
Dipole, Da:	4.7
IP(EA), eV:	-8.76(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(4-bromophenyl)sulfonylamino]-N-cyclopentyl-4-methylsulfanylbutanamide

Drug info:

PubChemData

Smile

CSCC[C@H](C(=O)NC1CCCC1)NS(=O)(=O)C2=CC=C(C=C2)Br

DOS

IR

Vibrations