Geometry & MOs

Info

ID:	387740
PubChem CID:	134986650
Reduced:	OC7H14 (1)
Stoich.:	AB7C14 (1)
Weight, g/mol:	262.081679
ΔH_f, kcal/mol:	-45.31
Dipole, Da:	1.62
IP(EA), eV:	-9.47(2.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-dihydroxy-3-methyl-5-propylphenyl)-2,2,2-trifluoroethanone

Drug info:

PubChemData

Smile

CCOC1[C@@H]([C@@H]1C)C

DOS

IR

Vibrations