Geometry & MOs

Info

ID:

110273

PubChem CID:

50318497

Reduced:

FN6O6C36H41 (1)

Stoich.:

AB6C6D36E41 (1)

Weight, g/mol:

648.287175

ΔHf, kcal/mol:

-246.56

Dipole, Da:

7.47

IP(EA), eV:

 -8.68(-0.33)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[2-[2-[(2,4-difluorophenyl)carbamoyl]anilino]-2-oxoethyl]-1-[2-[2-methyl-3-(propan-2-ylcarbamoyl)anilino]-2-oxoethyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1NC(=O)C(C)N2CCC(CC2)C(=O)N3CCCC3C(=O)NC4=CC(=C(C=C4)F)NC(=O)C5=CC(=CC=C5)OC)C(=O)N

DOS

IR

Vibrations