Geometry & MOs

Info

ID:	89580
PubChem CID:	49962829
Reduced:	BrFO3H14C15 (1)
Stoich.:	ABC3D14E15 (1)
Weight, g/mol:	257.93501
ΔH_f, kcal/mol:	-124.58
Dipole, Da:	7.19
IP(EA), eV:	-8.94(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-bromothiophen-2-yl)-(furan-2-yl)methanol

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1C(C2=CC=C(C=C2)F)O)Br)OC

DOS

IR

Vibrations