Geometry & MOs

Info

ID:	405726
PubChem CID:	135075164
Reduced:	SiO4C29H46 (1)
Stoich.:	AB4C29D46 (1)
Weight, g/mol:	330.110338
ΔH_f, kcal/mol:	-244.12
Dipole, Da:	1.06
IP(EA), eV:	-8.78(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6E)-6-[(3,4-dihydroxyphenyl)-hydroxymethylidene]-5-hydroxy-2-(3-methylbut-2-enyl)cyclohex-4-ene-1,3-dione

Drug info:

PubChemData

Smile

CC(=O)OC(CC(=C1CCCCC1)O[Si](C)(C)C(C)(C)C)O[C@@H](CCC2=CC=CC=C2)CC=C

DOS

IR

Vibrations