Geometry & MOs

Info

ID:

112314

PubChem CID:

50401792

Reduced:

F2O4N5C32H35 (1)

Stoich.:

A2B4C5D32E35 (1)

Weight, g/mol:

563.310769

ΔHf, kcal/mol:

-210.36

Dipole, Da:

9.01

IP(EA), eV:

 -9.1(-0.44)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[3-(cyclohexanecarbonylamino)-4-methoxyphenyl]-1-[2-[2-methyl-3-(methylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)C(C)N2CCC(CC2)C(=O)NCC(=O)NC3=CC(=CC=C3)F)C(=O)NCC4=CC=C(C=C4)F

DOS

IR

Vibrations