Geometry & MOs

Info

ID:	223430
PubChem CID:	85335034
Reduced:	N2S2O5H8C14 (1)
Stoich.:	A2B2C5D8E14 (1)
Weight, g/mol:	348.13192
ΔH_f, kcal/mol:	-112.33
Dipole, Da:	6.1
IP(EA), eV:	-9.38(-2.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2,5-dimethylpyrrolidin-1-yl)-2-hydroxypropyl]-2,5-difluorobenzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)SC2=CC=C(O2)C=C3C(=O)NC(=O)S3)C(=O)O

DOS

IR

Vibrations