Geometry & MOs

Info

ID:

388742

PubChem CID:

134990062

Reduced:

ON2C9H15 (1)

Stoich.:

AB2C9D15 (1)

Weight, g/mol:

254.021307

ΔHf, kcal/mol:

-4.07

Dipole, Da:

2.45

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 1.007565

Charge, e:

0

Chem-info

IUPAC name:

6,8-difluoro-2-methyl-2,3-dihydrofuro[3,2-c]chromene-4-thione

Drug info:

PubChemData

Smile

CN(C)C1=CC=CC(=[N+](C)C)O1

DOS

IR

Vibrations