Geometry & MOs

Info

ID:	208460
PubChem CID:	80532209
Reduced:	BrClOSF3H9C13 (1)
Stoich.:	ABCDE3F9G13 (1)
Weight, g/mol:	359.95864
ΔH_f, kcal/mol:	-160.93
Dipole, Da:	3.17
IP(EA), eV:	-9.6(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-bromo-4-chlorothiophen-2-yl)-(3-propoxyphenyl)methanol

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CC(C2=CC(=C(S2)Br)Cl)O)C(F)(F)F

DOS

IR

Vibrations