Geometry & MOs

Info

ID:	412807
PubChem CID:	135085736
Reduced:	LiOC8H13 (1)
Stoich.:	ABC8D13 (1)
Weight, g/mol:	188.008514
ΔH_f, kcal/mol:	-78.85
Dipole, Da:	5.38
IP(EA), eV:	-7.68(2.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-oxo-2-(2,4,6-trifluorophenyl)acetaldehyde

Drug info:

PubChemData

Smile

[Li+].CC[C@H]1CCCC(=C1)[O-]

DOS

IR

Vibrations