Geometry & MOs

Info

ID:	133579
PubChem CID:	51557347
Reduced:	NS3O5C19H19 (1)
Stoich.:	AB3C5D19E19 (1)
Weight, g/mol:	438.941451
ΔH_f, kcal/mol:	-128.96
Dipole, Da:	9.8
IP(EA), eV:	-8.49(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-(5-chlorothiophen-2-yl)sulfonylazanide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=CS3

DOS

IR

Vibrations