Geometry & MOs

Info

ID:	137913
PubChem CID:	52283540
Reduced:	FO3N6C22H22 (1)
Stoich.:	AB3C6D22E22 (1)
Weight, g/mol:	373.146013
ΔH_f, kcal/mol:	-75.03
Dipole, Da:	3.42
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.948104
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(methanesulfonamido)-N-(4-phenylphenyl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CN(CC(=O)N1)C2=[NH+]C=C(C=C2)NC(=O)NCC3=C(N=CC=C3)OC4=CC(=CC=C4)F

DOS

IR

Vibrations