Geometry & MOs

Info

ID:	90146
PubChem CID:	49966742
Reduced:	N2O2C15H20 (2)
Stoich.:	A2B2C15D20 (2)
Weight, g/mol:	512.259897
ΔH_f, kcal/mol:	-159.22
Dipole, Da:	9.91
IP(EA), eV:	-8.51(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-difluorophenyl)-1-[2-[2-methyl-5-(4-methylpiperidine-1-carbonyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)C2=CC(=C(C=C2)C)NC(=O)CN3CCC(CC3)C(=O)NC4=C(C=CC(=C4)C)OC

DOS

IR

Vibrations