Geometry & MOs

Info

ID:

113242

PubChem CID:

50436972

Reduced:

FN3O3C20H21 (2)

Stoich.:

AB3C3D20E21 (2)

Weight, g/mol:

520.228597

ΔHf, kcal/mol:

-270.76

Dipole, Da:

6.92

IP(EA), eV:

 -8.55(-0.42)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[3-[(4-fluorophenyl)carbamoyl]-2-methylanilino]-2-oxoethyl]-N-[(4-fluorophenyl)methyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)C(C)N2CCC(CC2)C(=O)NCCC(=O)NC3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)OC)C(=O)NC5=C(C=C(C=C5)F)F

DOS

IR

Vibrations