Geometry & MOs

Info

ID:	373933
PubChem CID:	131321444
Reduced:	BrF2O3C10H11 (1)
Stoich.:	AB2C3D10E11 (1)
Weight, g/mol:	252.036478
ΔH_f, kcal/mol:	-203.46
Dipole, Da:	3.4
IP(EA), eV:	-8.83(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(chloromethyl)-5-(difluoromethoxy)-1,3-dimethoxybenzene

Drug info:

PubChemData

Smile

COC1=CC(=CC(=C1OC)CBr)OC(F)F

DOS

IR

Vibrations