Geometry & MOs

Info

ID:

136951

PubChem CID:

52128369

Reduced:

NO2F3H12C17 (1)

Stoich.:

AB2C3D12E17 (1)

Weight, g/mol:

301.110279

ΔHf, kcal/mol:

-176.04

Dipole, Da:

5.24

IP(EA), eV:

-9.32(-1.21)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

5-methyl-N-naphthalen-1-yl-1-benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)OC(=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F

DOS

IR

Vibrations