Geometry & MOs

Info

ID:	153101
PubChem CID:	56312234
Reduced:	ClSN3O5C20H22 (1)
Stoich.:	ABC3D5E20F22 (1)
Weight, g/mol:	381.09139
ΔH_f, kcal/mol:	-143.12
Dipole, Da:	3.17
IP(EA), eV:	-7.84(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-[[1-(2-methoxyphenyl)pyrrolidin-3-yl]methyl]pyridine-3-sulfonamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CCC(C2)CNS(=O)(=O)C3=C(C=C4C(=C3)OCC(=O)N4)Cl

DOS

IR

Vibrations