Geometry & MOs

Info

ID:

120340

PubChem CID:

50723470

Reduced:

ClF2O4N5C31H40 (1)

Stoich.:

AB2C4D5E31F40 (1)

Weight, g/mol:

619.273689

ΔHf, kcal/mol:

-263.87

Dipole, Da:

6.34

IP(EA), eV:

 -8.91(-0.78)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-[1-[2-chloro-5-(diethylcarbamoyl)anilino]-1-oxopropan-2-yl]-N-[1-(2,6-difluoroanilino)-3-methyl-1-oxobutan-2-yl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations