Geometry & MOs

Info

ID:

91756

PubChem CID:

49978816

Reduced:

N6O7C32H42 (1)

Stoich.:

A6B7C32D42 (1)

Weight, g/mol:

650.342798

ΔHf, kcal/mol:

-269.63

Dipole, Da:

4.1

IP(EA), eV:

 -8.95(-0.54)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[1-[5-(dimethylcarbamoyl)-2-methoxyanilino]-1-oxopropan-2-yl]-1-[1-[2-methyl-5-(morpholine-4-carbonyl)anilino]-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)N2CCOCC2)NC(=O)C(C)N3CCC(CC3)C(=O)NC(C)C(=O)NC4=C(C=CC(=C4)C(=O)N)OC

DOS

IR

Vibrations