Geometry & MOs

Info

ID:

106668

PubChem CID:

50172477

Reduced:

N6O7C33H42 (1)

Stoich.:

A6B7C33D42 (1)

Weight, g/mol:

632.332233

ΔHf, kcal/mol:

-257.76

Dipole, Da:

6.62

IP(EA), eV:

 -8.97(-0.68)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-[2-(cyclopentylcarbamoyl)anilino]-2-oxoethyl]-1-[2-[2-methyl-4-(morpholine-4-carbonyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)N2CCOCC2)NC(=O)CN3CCC(CC3)C(=O)NCC(=O)NC4=CC=CC=C4C(=O)N5CCOCC5

DOS

IR

Vibrations