Geometry & MOs

Info

ID:	133608
PubChem CID:	51562315
Reduced:	FN2O3C21H23 (1)
Stoich.:	AB2C3D21E23 (1)
Weight, g/mol:	370.169271
ΔH_f, kcal/mol:	-131.37
Dipole, Da:	3.32
IP(EA), eV:	-8.52(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-(4-ethoxyphenyl)-1-(4-fluorobenzoyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NC(=O)[C@@H]2CCCN(C2)C(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations