Geometry & MOs

Info

ID:

94632

PubChem CID:

50002818

Reduced:

O3N4C30H42 (1)

Stoich.:

A3B4C30D42 (1)

Weight, g/mol:

632.368619

ΔHf, kcal/mol:

-137.45

Dipole, Da:

9.69

IP(EA), eV:

 -8.69(-0.14)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[2-[5-(butan-2-ylcarbamoyl)-2-methylanilino]-2-oxoethyl]piperidine-4-carbonyl]-N-[5-(dimethylcarbamoyl)-2-methylphenyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCC(C)NC(=O)C1=CC(=C(C=C1)C)NC(=O)C(C)N2CCC(CC2)C(=O)NC3=CC=CC=C3C(C)C

DOS

IR

Vibrations