Geometry & MOs

Info

ID:	334021
PubChem CID:	127252573
Reduced:	NO4H23C27 (1)
Stoich.:	AB4C23D27 (1)
Weight, g/mol:	486.131468
ΔH_f, kcal/mol:	-60.77
Dipole, Da:	4.87
IP(EA), eV:	-8.47(-1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z)-9-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(3,4-dimethoxyphenyl)methylidene]-8,9-dihydrofuro[2,3-f]chromene-3,7-dione

Drug info:

PubChemData

Smile

COC1=C(C2=C(C=C1)C3=C(C4=CC=CC=C4C3=O)N(C2=O)CCCC5=CC=CC=C5)OC

DOS

IR

Vibrations