Geometry & MOs

Info

ID:	262391
PubChem CID:	103290207
Reduced:	ON2F4H12C14 (1)
Stoich.:	AB2C4D12E14 (1)
Weight, g/mol:	250.061692
ΔH_f, kcal/mol:	-167.67
Dipole, Da:	3.71
IP(EA), eV:	-9.05(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-1-(2,3,5,6-tetrafluoro-4-hydroxyphenyl)propan-1-one

Drug info:

PubChemData

Smile

CCNC1=CC(=NC=C1)COC2=C(C(=CC(=C2F)F)F)F

DOS

IR

Vibrations