Geometry & MOs

Info

ID:

67488

PubChem CID:

46506564

Reduced:

FN2O3H17C23 (1)

Stoich.:

AB2C3D17E23 (1)

Weight, g/mol:

343.079076

ΔHf, kcal/mol:

-57.68

Dipole, Da:

5.5

IP(EA), eV:

-9.07(-1.27)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(2-fluorophenyl)imino-5-(hydroxymethyl)-8-methylpyrano[2,3-c]pyridine-3-carbothioamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=CC3=C(C=C2)C=C(C(=NC4=CC(=CC=C4)F)O3)C(=O)N

DOS

IR

Vibrations