Geometry & MOs

Info

ID:	97512
PubChem CID:	50032234
Reduced:	O4N5C36H45 (1)
Stoich.:	A4B5C36D45 (1)
Weight, g/mol:	520.228597
ΔH_f, kcal/mol:	-147.12
Dipole, Da:	7.73
IP(EA), eV:	-8.58(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[5-[(2,6-difluorophenyl)carbamoyl]-2-methylanilino]-1-oxopropan-2-yl]-N-phenylpiperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2)NC(=O)CN3CCC(CC3)C(=O)NC(C(C)C)C(=O)NC4=CC=C(C=C4)C(C)C

DOS

IR

Vibrations