Geometry & MOs

Info

ID:	353133
PubChem CID:	127284313
Reduced:	ClSN3O3C16H18 (1)
Stoich.:	ABC3D3E16F18 (1)
Weight, g/mol:	258.136828
ΔH_f, kcal/mol:	-107.55
Dipole, Da:	7.26
IP(EA), eV:	-9.04(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-oxopiperidin-3-yl)-2,3-dihydro-1H-indene-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(C(=O)NC1)NC(=O)C2CSCN2C(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations