Geometry & MOs

Info

ID:	12185
PubChem CID:	132026
Reduced:	O3C10H10 (2)
Stoich.:	A3B10C10 (2)
Weight, g/mol:	356.125988
ΔH_f, kcal/mol:	-208.77
Dipole, Da:	1.04
IP(EA), eV:	-9.55(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4aS,12bR)-8,10-dihydroxy-2-(hydroxymethyl)-5,5-dimethyl-3,4,4a,12b-tetrahydronaphtho[2,3-c]isochromene-7,12-dione

Drug info:

PubChemData

Smile

CC1([C@H]2CCC(=C[C@H]2C3=C(O1)C(=O)C4=C(C3=O)C=C(C=C4O)O)CO)C

DOS

IR

Vibrations