Geometry & MOs

Info

ID:	68618
PubChem CID:	46508775
Reduced:	O2N5C27H27 (1)
Stoich.:	A2B5C27D27 (1)
Weight, g/mol:	466.258006
ΔH_f, kcal/mol:	19.76
Dipole, Da:	3.49
IP(EA), eV:	-8.98(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-butyl-2-(2-methoxyphenyl)-N-(6-morpholin-4-ylpyridin-3-yl)-6-oxopiperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=CC=C3)CNC(=O)CC(C4=CC=CC=C4)NC(=O)N

DOS

IR

Vibrations