Geometry & MOs

Info

ID:	144315
PubChem CID:	53348873
Reduced:	NO7C21H29 (1)
Stoich.:	AB7C21D29 (1)
Weight, g/mol:	358.105253
ΔH_f, kcal/mol:	-284.73
Dipole, Da:	6.71
IP(EA), eV:	-8.6(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E,3aS,4R,8bS)-4-(methoxymethoxy)-3-[(4-methyl-5-oxo-2H-furan-2-yl)oxymethylidene]-4,8b-dihydro-3aH-indeno[1,2-b]furan-2-one

Drug info:

PubChemData

Smile

CC/C(=C(/COC1=CC=C(C=C1)OC)\NC(=O)C(=O)OCC)/C(=O)OC(C)(C)C

DOS

IR

Vibrations