Geometry & MOs

Info

ID:

109122

PubChem CID:

50273615

Reduced:

F3O4N5C35H38 (1)

Stoich.:

A3B4C5D35E38 (1)

Weight, g/mol:

599.290783

ΔHf, kcal/mol:

-281.54

Dipole, Da:

9.15

IP(EA), eV:

 -8.8(-0.49)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(4-fluorophenyl)-1-[1-[1-[2-methyl-4-(phenylcarbamoyl)anilino]-1-oxopropan-2-yl]piperidine-4-carbonyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)NC2=CC=CC=C2)NC(=O)C(C)N3CCC(CC3)C(=O)N4CCCC4C(=O)NC5=CC=CC(=C5)C(F)(F)F

DOS

IR

Vibrations