Geometry & MOs

Info

ID:

104885

PubChem CID:

50105873

Reduced:

F2N5O5C36H43 (1)

Stoich.:

A2B5C5D36E43 (1)

Weight, g/mol:

649.307576

ΔHf, kcal/mol:

-268.35

Dipole, Da:

9.92

IP(EA), eV:

 -8.34(-0.71)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[5-[(3,4-difluorophenyl)carbamoyl]-2-methylanilino]-1-oxopropan-2-yl]-N-[1-(3-methoxyanilino)-3-methyl-1-oxobutan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NC(=O)C(C(C)C)NC(=O)C2CCN(CC2)C(C)C(=O)NC3=C(C=CC(=C3)C(=O)NC4=CC(=C(C=C4)F)F)C

DOS

IR

Vibrations