Geometry & MOs

Info

ID:

112764

PubChem CID:

50418708

Reduced:

F2O5N6H36C37 (1)

Stoich.:

A2B5C6D36E37 (1)

Weight, g/mol:

700.262103

ΔHf, kcal/mol:

-220.91

Dipole, Da:

8.33

IP(EA), eV:

 -8.63(-0.86)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[2-[3-[(2,5-difluorophenyl)carbamoyl]-2-methylanilino]-2-oxoethyl]-N-[2-[2-[(4-fluorophenyl)carbamoyl]anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)CN2CCC(CC2)C(=O)NCC(=O)NC3=CC=CC=C3C(=O)NC4=CC=CC=C4)C(=O)NC5=C(C=CC(=C5)F)F

DOS

IR

Vibrations