Geometry & MOs

Info

ID:	95275
PubChem CID:	50007672
Reduced:	F3O3N4C24H27 (1)
Stoich.:	A3B3C4D24E27 (1)
Weight, g/mol:	563.234411
ΔH_f, kcal/mol:	-256.01
Dipole, Da:	1.41
IP(EA), eV:	-9.22(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2,4-difluorophenyl)carbamoyl]phenyl]-1-[2-[2-methyl-5-(methylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC)NC(=O)CN2CCC(CC2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

DOS

IR

Vibrations