Geometry & MOs

Info

ID:	25943
PubChem CID:	634473
Reduced:	OH12C15 (2)
Stoich.:	AB12C15 (2)
Weight, g/mol:	416.183503
ΔH_f, kcal/mol:	12.22
Dipole, Da:	1.39
IP(EA), eV:	-8.37(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.02,7.014,18]nonadeca-1(19),2,4,6,12,14(18)-hexaen-11-ol

Drug info:

PubChemData

Smile

C1CCC2=CC3=C(C=CC4=CC=CC=C43)OC25C(=CC6=C(O5)C=CC7=CC=CC=C76)CC1

DOS

IR

Vibrations