Geometry & MOs

Info

ID:	386613
PubChem CID:	134982326
Reduced:	NO7C26H31 (1)
Stoich.:	AB7C26D31 (1)
Weight, g/mol:	702.48594
ΔH_f, kcal/mol:	-263.69
Dipole, Da:	2.29
IP(EA), eV:	-8.48(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,7,10,11-tetrahexoxy-2,3-dimethoxy-1-methyltriphenylene

Drug info:

PubChemData

Smile

CCOC(=O)C1(CC(C2=C1C=CC(=C2OC)OC)CNC(=O)CC3=CC=CC=C3)C(=O)OCC

DOS

IR

Vibrations