Geometry & MOs

Info

ID:

111486

PubChem CID:

50370119

Reduced:

O5N6C37H48 (1)

Stoich.:

A5B6C37D48 (1)

Weight, g/mol:

670.384269

ΔHf, kcal/mol:

-203.1

Dipole, Da:

6.93

IP(EA), eV:

 -8.9(-0.26)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[2-[3-(cyclopentylcarbamoyl)-2-methylanilino]-2-oxoethyl]piperidine-4-carbonyl]-N-[3-(piperidine-1-carbonyl)phenyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)CN2CCC(CC2)C(=O)N3CCCC3C(=O)NC4=CC=CC(=C4)C(=O)N5CCCC5)C(=O)NC6CCCC6

DOS

IR

Vibrations