Geometry & MOs

Info

ID:	215126
PubChem CID:	85084196
Reduced:	O8C17H22 (1)
Stoich.:	A8B17C22 (1)
Weight, g/mol:	708.199547
ΔH_f, kcal/mol:	-352.23
Dipole, Da:	1.68
IP(EA), eV:	-10.95(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-[7-[4-(2-hydroxynaphthalene-1-carbonyl)oxy-3-methoxyphenyl]-3,5-dioxohepta-1,6-dienyl]-2-methoxyphenyl] 2-hydroxynaphthalene-1-carboxylate

Drug info:

PubChemData

Smile

CC12CCC3(C1(CC(=O)O2)C(C4(C3(C(OC4=O)O)C)C)C(=O)OC)O

DOS

IR

Vibrations