Geometry & MOs

Info

ID:	315476
PubChem CID:	126626916
Reduced:	BrSO2C14H19 (1)
Stoich.:	ABC2D14E19 (1)
Weight, g/mol:	213.97934
ΔH_f, kcal/mol:	-75.58
Dipole, Da:	3.25
IP(EA), eV:	-8.43(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-7-fluoro-2,3-dihydro-1H-indene

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Br)C)OCC2CCS(=O)CC2

DOS

IR

Vibrations