Geometry & MOs

Info

ID:

180523

PubChem CID:

76648567

Reduced:

PtN3O4H26C29 (1)

Stoich.:

AB3C4D26E29 (1)

Weight, g/mol:

649.201671

ΔHf, kcal/mol:

102.2

Dipole, Da:

4.1

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 1.725977

Charge, e:

0

Chem-info

IUPAC name:

2-(4-methoxypyridin-2-yl)-N,N-dimethylbenzene-3-id-1-amine;platinum(2+)

Drug info:

PubChemData

Smile

CC(=CC(=O)C)O.COC1=CC(=C([C-]=C1)C2=NC=CC(=C2)N3C4=C(C=NC=C4)C5=CC=CC=C53)OC.[Pt]

DOS

IR

Vibrations