Geometry & MOs

Info

ID:

323505

PubChem CID:

126675056

Reduced:

F2S2N4O5H22C24 (1)

Stoich.:

A2B2C4D5E22F24 (1)

Weight, g/mol:

520.155826

ΔHf, kcal/mol:

-177.74

Dipole, Da:

4.07

IP(EA), eV:

 -9.36(-1.56)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-[1-[(1-cyanocyclopropyl)carbamoyl]-4,4-difluorocyclohexyl]-6-(2-oxo-3H-1,3-benzoxazol-5-yl)-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=NC(=CS1)C2=CC3=C(C=C2)C=C(O3)C(=O)NC4(CCC(CC4)(F)F)C(=O)NC5(CC5)C#N

DOS

IR

Vibrations