Geometry & MOs

Info

ID:	102358
PubChem CID:	50066626
Reduced:	FN2O2C15H16 (2)
Stoich.:	AB2C2D15E16 (2)
Weight, g/mol:	548.259897
ΔH_f, kcal/mol:	-200.59
Dipole, Da:	5.4
IP(EA), eV:	-8.49(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[5-[(2,5-difluorophenyl)carbamoyl]-2-methylanilino]-1-oxopropan-2-yl]-N-(2,4-dimethylphenyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)F)F)NC(=O)C(C)N3CCC(CC3)C(=O)NC4=CC=CC=C4OC

DOS

IR

Vibrations