Geometry & MOs

Info

ID:

113625

PubChem CID:

50452425

Reduced:

ClF2O4N5H28C29 (1)

Stoich.:

AB2C4D5E28F29 (1)

Weight, g/mol:

625.226739

ΔHf, kcal/mol:

-207.02

Dipole, Da:

7.6

IP(EA), eV:

 -9.15(-0.84)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[3-chloro-4-(propylcarbamoyl)phenyl]-1-[2-[3-[(2,4-difluorophenyl)carbamoyl]-2-methylanilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)CN2CCC(CC2)C(=O)NC3=CC(=C(C=C3)C(=O)N)Cl)C(=O)NC4=C(C=C(C=C4)F)F

DOS

IR

Vibrations