Geometry & MOs

Info

ID:	25155
PubChem CID:	619723
Reduced:	O3H12C16 (1)
Stoich.:	A3B12C16 (1)
Weight, g/mol:	384.23006
ΔH_f, kcal/mol:	-39.31
Dipole, Da:	3.61
IP(EA), eV:	-9.08(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,4-bis(3-ethoxypropyl)anthracene-1,4-diol

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C(=O)C(=CC3=CC=CC=C3)O2

DOS

IR

Vibrations