Geometry & MOs

Info

ID:

105663

PubChem CID:

50135630

Reduced:

O5N6C37H48 (1)

Stoich.:

A5B6C37D48 (1)

Weight, g/mol:

602.321668

ΔHf, kcal/mol:

-208.03

Dipole, Da:

7.09

IP(EA), eV:

 -8.74(-0.38)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-(methylcarbamoyl)phenyl]-1-[1-[2-[2-methyl-4-(pyrrolidine-1-carbonyl)anilino]-2-oxoethyl]piperidine-4-carbonyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)N2CCCC2)NC(=O)CN3CCC(CC3)C(=O)N4CCCC4C(=O)NC5=CC=CC=C5C(=O)NC6CCCC6

DOS

IR

Vibrations