Geometry & MOs

Info

ID:

117156

PubChem CID:

50593250

Reduced:

ClFO3N4C27H32 (1)

Stoich.:

ABC3D4E27F32 (1)

Weight, g/mol:

700.254289

ΔHf, kcal/mol:

-162.26

Dipole, Da:

7.87

IP(EA), eV:

 -8.98(-0.56)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-[4-chloro-3-(3-methylpiperidine-1-carbonyl)anilino]-2-oxoethyl]-1-[2-[4-chloro-3-(morpholine-4-carbonyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC(=C(C=C1)Cl)C(=O)NC2CCCC2)N3CCC(CC3)C(=O)NC4=CC=C(C=C4)F

DOS

IR

Vibrations