Geometry & MOs

Info

ID:	368809
PubChem CID:	127330227
Reduced:	SO2N3C22H29 (1)
Stoich.:	AB2C3D22E29 (1)
Weight, g/mol:	394.047956
ΔH_f, kcal/mol:	-101.21
Dipole, Da:	4.24
IP(EA), eV:	-8.56(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1-benzothiophen-3-yl)-1-thiophen-2-ylsulfonylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)(C3)NC(=O)NCCC(=O)NC4CSC5=CC=CC=C45

DOS

IR

Vibrations