Geometry & MOs

Info

ID:	13749
PubChem CID:	397489
Reduced:	OF2N2S2H10C13 (1)
Stoich.:	AB2C2D2E10F13 (1)
Weight, g/mol:	312.020262
ΔH_f, kcal/mol:	-60.99
Dipole, Da:	5.54
IP(EA), eV:	-9.01(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-difluoro-1-imidazo[2,1-b][1,3]thiazol-5-yl-2-phenylsulfanylethanol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)SC(C(C2=CN=C3N2C=CS3)O)(F)F

DOS

IR

Vibrations