Geometry & MOs

Info

ID:

115402

PubChem CID:

50521882

Reduced:

ClF2O4N5C28H34 (1)

Stoich.:

AB2C4D5E28F34 (1)

Weight, g/mol:

700.290674

ΔHf, kcal/mol:

-259.71

Dipole, Da:

6.66

IP(EA), eV:

 -9.05(-0.54)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[1-[2-chloro-5-(4-methylpiperidine-1-carbonyl)anilino]-1-oxopropan-2-yl]-1-[1-[4-chloro-3-(propan-2-ylcarbamoyl)anilino]-1-oxopropan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)C(C)N2CCC(CC2)C(=O)NC(C)C(=O)NC3=CC(=C(C=C3)F)F)Cl

DOS

IR

Vibrations