Geometry & MOs

Info

ID:	46388
PubChem CID:	10524186
Reduced:	O5H18C24 (1)
Stoich.:	A5B18C24 (1)
Weight, g/mol:	386.151809
ΔH_f, kcal/mol:	-85.32
Dipole, Da:	1.93
IP(EA), eV:	-8.49(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(benzoyloxymethyl)-1,3-dihydroinden-2-yl]methyl benzoate

Drug info:

PubChemData

Smile

C1=CC(=CC=C1O)OC2=CC=C(C=C2)OC3=CC=C(C=C3)OC4=CC=C(C=C4)O

DOS

IR

Vibrations