Geometry & MOs

Info

ID:

97268

PubChem CID:

50029487

Reduced:

F2N5O5C34H37 (1)

Stoich.:

A2B5C5D34E37 (1)

Weight, g/mol:

631.297011

ΔHf, kcal/mol:

-252.83

Dipole, Da:

10.18

IP(EA), eV:

 -8.99(-0.65)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-(cyclopentylcarbamoyl)-6-methylphenyl]-1-[2-[5-[(2,5-difluorophenyl)carbamoyl]-2-methylanilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)N2CCOCC2)NC(=O)C3CCN(CC3)CC(=O)NC4=C(C=CC(=C4)C(=O)NC5=C(C=CC(=C5)F)F)C

DOS

IR

Vibrations