Geometry & MOs

Info

ID:	260957
PubChem CID:	103210972
Reduced:	BrOCl2F3H10C11 (1)
Stoich.:	ABC2D3E10F11 (1)
Weight, g/mol:	326.01293
ΔH_f, kcal/mol:	-203.37
Dipole, Da:	2.71
IP(EA), eV:	-9.67(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-bromo-2-(2,2,2-trifluoroethoxy)ethyl]-1-methoxy-4-methylbenzene

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C(CCOCC(F)(F)F)Br)Cl)Cl

DOS

IR

Vibrations