Geometry & MOs

Info

ID:	237719
PubChem CID:	92721060
Reduced:	ON3C21H23 (1)
Stoich.:	AB3C21D23 (1)
Weight, g/mol:	434.108248
ΔH_f, kcal/mol:	14.52
Dipole, Da:	6.93
IP(EA), eV:	-9.09(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1CCC[C@H]1C2=NC3=CC=CC=C3N2CCC4=CC=CC=C4

DOS

IR

Vibrations