Geometry & MOs

Info

ID:	260939
PubChem CID:	103210340
Reduced:	ClFIOH13C15 (1)
Stoich.:	ABCDE13F15 (1)
Weight, g/mol:	311.99728
ΔH_f, kcal/mol:	-52.99
Dipole, Da:	0.83
IP(EA), eV:	-9.54(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-bromo-4-fluorophenyl)-3-(2,2-difluoroethoxy)propan-1-ol

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1F)C)C(C2=CC(=C(C=C2)I)Cl)O

DOS

IR

Vibrations