Geometry & MOs

Info

ID:

226421

PubChem CID:

87351908

Reduced:

O16C53H56 (1)

Stoich.:

A16B53C56 (1)

Weight, g/mol:

627.91599

ΔHf, kcal/mol:

-559.29

Dipole, Da:

14.96

IP(EA), eV:

-9.94(-1.47)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N,N-diiodocyclopentanamine;(1,3-dimethylimidazol-2-ylidene)platinum

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1OCC(=O)O)C=O)C2(CCC(CC2)CC3CCC(CC3)(C4=CC(=C(C(=C4)C)OCC(=O)O)C=O)C5=CC(=C(C(=C5)C)OCC(=O)O)C=O)C6=CC(=C(C(=C6)C)OCC(=O)O)C=O

DOS

IR

Vibrations