Geometry & MOs

Info

ID:	31169
PubChem CID:	854940
Reduced:	ON3C9H9 (1)
Stoich.:	AB3C9D9 (1)
Weight, g/mol:	269.068808
ΔH_f, kcal/mol:	25.11
Dipole, Da:	1.77
IP(EA), eV:	-9.02(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4bR,9bS)-7-amino-4b,9b-dihydroxyindeno[1,2-b][1]benzofuran-10-one

Drug info:

PubChemData

Smile

CC1=NC(=NN1)C2=CC=CC=C2O

DOS

IR

Vibrations