Geometry & MOs

Info

ID:	155642
PubChem CID:	56366554
Reduced:	O2N4C25H26 (1)
Stoich.:	A2B4C25D26 (1)
Weight, g/mol:	438.226705
ΔH_f, kcal/mol:	-12.37
Dipole, Da:	8.17
IP(EA), eV:	-8.53(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-oxo-3-(pyridin-4-ylmethylamino)propyl]-1-(3-phenoxypropanoyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(CC2=CC=CC=C21)C3=CC=C(C=C3)C(=O)NCCC(=O)NCC4=CC=NC=C4

DOS

IR

Vibrations