Geometry & MOs

Info

ID:

91477

PubChem CID:

49976167

Reduced:

N6O7C34H44 (1)

Stoich.:

A6B7C34D44 (1)

Weight, g/mol:

627.305684

ΔHf, kcal/mol:

-266.82

Dipole, Da:

9.0

IP(EA), eV:

 -9.12(-0.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-[(3-methoxybenzoyl)amino]phenyl]-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)CN3CCC(CC3)C(=O)NC(C)C(=O)NC4=CC=CC(=C4)C(=O)N5CCOCC5

DOS

IR

Vibrations