Geometry & MOs

Info

ID:	100064
PubChem CID:	50057958
Reduced:	O3N4C30H34 (1)
Stoich.:	A3B4C30D34 (1)
Weight, g/mol:	506.212947
ΔH_f, kcal/mol:	-83.6
Dipole, Da:	6.53
IP(EA), eV:	-8.78(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,6-difluorophenyl)-1-[2-[2-methyl-5-(phenylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)NC(=O)C2CCN(CC2)CC(=O)NC3=C(C=CC(=C3)C(=O)NC4=CC=CC=C4)C

DOS

IR

Vibrations