Geometry & MOs

Info

ID:

107068

PubChem CID:

50187807

Reduced:

O3N4C31H42 (1)

Stoich.:

A3B4C31D42 (1)

Weight, g/mol:

637.303097

ΔHf, kcal/mol:

-134.2

Dipole, Da:

6.8

IP(EA), eV:

 -8.77(-0.28)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[4-chloro-2-(morpholine-4-carbonyl)phenyl]-1-[1-[2-methyl-4-(4-methylpiperidine-1-carbonyl)anilino]-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)NC2CCCCC2)NC(=O)CN3CCC(CC3)C(=O)NC4=CC=C(C=C4)C(C)C

DOS

IR

Vibrations