Geometry & MOs

Info

ID:	52248
PubChem CID:	12015056
Reduced:	O2H9C10 (2)
Stoich.:	A2B9C10 (2)
Weight, g/mol:	208.109944
ΔH_f, kcal/mol:	-96.78
Dipole, Da:	2.96
IP(EA), eV:	-8.7(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(hydroxymethyl)-5-methoxy-2,3-dihydroinden-1-yl]methanol

Drug info:

PubChemData

Smile

C1CC(C2=C1C=CC3=CC=CC=C32)(CO)COC(=O)C4=CC=CO4

DOS

IR

Vibrations