Geometry & MOs

Info

ID:	370148
PubChem CID:	127337521
Reduced:	ClFON5C19H23 (1)
Stoich.:	ABCD5E19F23 (1)
Weight, g/mol:	378.162267
ΔH_f, kcal/mol:	-48.26
Dipole, Da:	3.19
IP(EA), eV:	-8.53(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3-chloro-4-fluorophenyl)ethyl]-3-(2-ethylimidazol-1-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N2CCCC(C2)NC(=O)NC(C)C3=CC(=C(C=C3)F)Cl

DOS

IR

Vibrations