Geometry & MOs

Info

ID:	25709
PubChem CID:	629454
Reduced:	OSC30H54 (1)
Stoich.:	ABC30D54 (1)
Weight, g/mol:	322.084124
ΔH_f, kcal/mol:	-135.73
Dipole, Da:	4.19
IP(EA), eV:	-8.94(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(4-methoxyphenyl)ethenyl]-4-oxochromene-6-carboxylic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCC1=C(C=C(S1)C(=O)CCCCCCCCCCC)C

DOS

IR

Vibrations