Geometry & MOs

Info

ID:

107785

PubChem CID:

50218785

Reduced:

F4O4N5C36H39 (1)

Stoich.:

A4B4C5D36E39 (1)

Weight, g/mol:

631.297011

ΔHf, kcal/mol:

-334.43

Dipole, Da:

2.7

IP(EA), eV:

 -9.02(-0.51)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(4-fluorophenyl)-1-[1-[1-[4-[(4-fluorophenyl)methylcarbamoyl]-2-methylanilino]-1-oxopropan-2-yl]piperidine-4-carbonyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)NCC2=CC=C(C=C2)F)NC(=O)C(C)N3CCC(CC3)C(=O)N4CCCC4C(=O)NC5=CC=CC(=C5)C(F)(F)F

DOS

IR

Vibrations