Geometry & MOs

Info

ID:	367886
PubChem CID:	127326039
Reduced:	O2N3C24H29 (1)
Stoich.:	A2B3C24D29 (1)
Weight, g/mol:	373.216555
ΔH_f, kcal/mol:	-49.47
Dipole, Da:	3.94
IP(EA), eV:	-8.59(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopropylmethyl)-1-[1-(3-fluorophenyl)-2-oxopiperidin-3-yl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(=O)NC2CCN(CC2)C3CCCN(C3=O)C4=CC=CC=C4

DOS

IR

Vibrations