Geometry & MOs

Info

ID:

144504

PubChem CID:

53378719

Reduced:

SF2N2O4H24C30 (1)

Stoich.:

AB2C2D4E24F30 (1)

Weight, g/mol:

573.140356

ΔHf, kcal/mol:

-142.18

Dipole, Da:

6.71

IP(EA), eV:

 -8.88(-1.09)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-(4-fluorophenyl)-N-methyl-6-[2-[methyl(methylsulfonyl)amino]ethyl-methylsulfonylamino]-5-phenyl-1-benzofuran-3-carboxamide

Drug info:

PubChemData

Smile

CNC(=O)C1=C(OC2=CC(=C(C=C21)C3=CC=CC=C3)N(CC4=CC=C(C=C4)F)S(=O)(=O)C)C5=CC=C(C=C5)F

DOS

IR

Vibrations