Geometry & MOs

Info

ID:

112286

PubChem CID:

50400415

Reduced:

N2O2C14H19 (2)

Stoich.:

A2B2C14D19 (2)

Weight, g/mol:

734.359197

ΔHf, kcal/mol:

-148.92

Dipole, Da:

11.62

IP(EA), eV:

 -7.85(-0.32)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[3-[(4-fluorophenyl)methylcarbamoyl]-2-methylanilino]-1-oxopropan-2-yl]-N-[1-[3-methyl-4-[(4-methylbenzoyl)amino]anilino]-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C1=C(C(=CC=C1)NC(=O)C(C)N2CCC(CC2)C(=O)NC3=CC=C(C=C3)OC)C

DOS

IR

Vibrations