Geometry & MOs

Info

ID:	200514
PubChem CID:	79403919
Reduced:	OSC17H18 (1)
Stoich.:	ABC17D18 (1)
Weight, g/mol:	387.89551
ΔH_f, kcal/mol:	-3.91
Dipole, Da:	2.32
IP(EA), eV:	-8.35(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dibromo-2-(2-phenylsulfanylethoxy)benzene

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)OCC2CSC3=CC=CC=C23

DOS

IR

Vibrations