Geometry & MOs

Info

ID:	370082
PubChem CID:	127337383
Reduced:	OSN4C20H24 (1)
Stoich.:	ABC4D20E24 (1)
Weight, g/mol:	332.257612
ΔH_f, kcal/mol:	11.09
Dipole, Da:	5.86
IP(EA), eV:	-8.62(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-cyclohexylethyl)-3-(2-ethylimidazol-1-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC=CN1C2CCCN(C2)C(=O)NCC3=CSC4=CC=CC=C43

DOS

IR

Vibrations