Geometry & MOs

Info

ID:	388743
PubChem CID:	134990064
Reduced:	SF2O2H8C12 (1)
Stoich.:	AB2C2D8E12 (1)
Weight, g/mol:	291.90052
ΔH_f, kcal/mol:	-118.13
Dipole, Da:	5.12
IP(EA), eV:	-8.88(-1.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-6,8-difluoro-2-sulfanylchromen-4-one

Drug info:

PubChemData

Smile

CC1CC2=C(O1)C3=C(C(=CC(=C3)F)F)OC2=S

DOS

IR

Vibrations