Geometry & MOs

Info

ID:	370021
PubChem CID:	127337236
Reduced:	ON4C21H28 (1)
Stoich.:	AB4C21D28 (1)
Weight, g/mol:	380.117067
ΔH_f, kcal/mol:	-21.49
Dipole, Da:	5.67
IP(EA), eV:	-8.92(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2,4-dichlorophenyl)methyl]-3-(2-ethylimidazol-1-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CCC1=NC=CN1C2CCCN(C2)C(=O)NC3CCCC4=CC=CC=C34

DOS

IR

Vibrations