Geometry & MOs

Info

ID:	383842
PubChem CID:	134975819
Reduced:	LiO2C6H11 (1)
Stoich.:	AB2C6D11 (1)
Weight, g/mol:	202.09938
ΔH_f, kcal/mol:	-74.35
Dipole, Da:	6.37
IP(EA), eV:	-7.45(1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(4-methoxyphenyl)hexa-1,5-dien-3-one

Drug info:

PubChemData

Smile

[Li+].CCOC(C)O[C-]=C

DOS

IR

Vibrations