Geometry & MOs

Info

ID:

51644

PubChem CID:

12014349

Reduced:

OH6C8 (4)

Stoich.:

AB6C8 (4)

Weight, g/mol:

476.198759

ΔHf, kcal/mol:

73.87

Dipole, Da:

0.24

IP(EA), eV:

 -8.06(-0.16)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3,12,15,24-tetramethoxypentacyclo[19.3.1.12,6.19,13.114,18]octacosa-1(24),2,4,6(28),7,9(27),10,12,14,16,18(26),19,21(25),22-tetradecaene

Drug info:

PubChemData

Smile

COC1=C2C=C(C=C1)C#CC3=CC(=C(C=C3)OC)C4=C(C=CC(=C4)C#CC5=CC2=C(C=C5)OC)OC

DOS

IR

Vibrations