Geometry & MOs

Info

ID:	370103
PubChem CID:	127337435
Reduced:	ClN3O3C19H28 (1)
Stoich.:	AB3C3D19E28 (1)
Weight, g/mol:	366.12811
ΔH_f, kcal/mol:	-119.84
Dipole, Da:	3.33
IP(EA), eV:	-9.15(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5-chlorothiophen-2-yl)ethyl]-3-(2-ethylimidazol-1-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1COCCC1CN2CCN(CC2)C(=O)NCCOC3=CC(=CC=C3)Cl

DOS

IR

Vibrations