Geometry & MOs

Info

ID:

106208

PubChem CID:

50152647

Reduced:

FO4N5C31H42 (1)

Stoich.:

AB4C5D31E42 (1)

Weight, g/mol:

666.352969

ΔHf, kcal/mol:

-222.34

Dipole, Da:

4.6

IP(EA), eV:

 -8.97(-0.3)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[2-methyl-4-(3-methylpiperidine-1-carbonyl)anilino]-2-oxoethyl]-N-[2-[2-methyl-6-(phenylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)NCC(C)C)NC(=O)C(C)N2CCC(CC2)C(=O)NC(C)C(=O)NC3=C(C=C(C=C3)F)C

DOS

IR

Vibrations