Geometry & MOs

Info

ID:	205992
PubChem CID:	80187367
Reduced:	SN3O4C13H19 (1)
Stoich.:	AB3C4D13E19 (1)
Weight, g/mol:	280.215078
ΔH_f, kcal/mol:	-83.12
Dipole, Da:	4.87
IP(EA), eV:	-9.13(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(2-methylpropyl)cyclopentyl]methyl]-6-oxopiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1(CCN(C1)S(=O)(=O)C2=C(C=C(C=C2)[N+](=O)[O-])NC)C

DOS

IR

Vibrations