Geometry & MOs

Info

ID:

170352

PubChem CID:

75219980

Reduced:

O17C45H58 (1)

Stoich.:

A17B45C58 (1)

Weight, g/mol:

503.084795

ΔHf, kcal/mol:

-683.68

Dipole, Da:

5.16

IP(EA), eV:

 -8.92(-1.2)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

copper;N'-[[8-(furan-2-yl)-2-hydroxy-13-tricyclo[7.3.1.02,7]tridecanylidene]amino]carbamimidothioate;thiocyanate;dihydrate

Drug info:

PubChemData

Smile

CCC=CCC=CCC=CCCCCCCCC(=O)OC1C(OC(C(C1O)O)OCC2C(C(C(C(O2)OC3=C(OC4=CC(=CC(=C4C3=O)O)O)C5=CC(=C(C=C5)O)O)O)O)O)C

DOS

IR

Vibrations