Geometry & MOs

Info

ID:	300208
PubChem CID:	121269855
Reduced:	SF4H12C16 (1)
Stoich.:	AB4C12D16 (1)
Weight, g/mol:	415.980014
ΔH_f, kcal/mol:	-157.61
Dipole, Da:	4.68
IP(EA), eV:	-8.9(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(1-benzothiophen-4-yloxy)-4-(difluoromethyl)-2,2-difluoro-1,1-dioxo-1-benzothiophen-3-one

Drug info:

PubChemData

Smile

C1C2=C(C=CC(=C2[C@H](C1(F)F)F)F)SCC3=CC=CC=C3

DOS

IR

Vibrations