Geometry & MOs

Info

ID:	278470
PubChem CID:	103836057
Reduced:	ClNSO3C13H18 (1)
Stoich.:	ABCD3E13F18 (1)
Weight, g/mol:	314.093643
ΔH_f, kcal/mol:	-134.72
Dipole, Da:	5.98
IP(EA), eV:	-9.9(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(hydroxymethyl)cyclopentyl]-1-(4-nitrophenyl)methanesulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)Cl)S(=O)(=O)NC2CCCC2CO

DOS

IR

Vibrations