Geometry & MOs

Info

ID:

125643

PubChem CID:

50930858

Reduced:

SO4N5C28H30 (1)

Stoich.:

AB4C5D28E30 (1)

Weight, g/mol:

287.069353

ΔHf, kcal/mol:

7.24

Dipole, Da:

32.36

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.875936

Charge, e:

 0

Chem-info

IUPAC name:

cobalt;(Z)-4-hydroxy-3-methylpent-3-en-2-one

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C2=[N+](C(=NN2)SCC(=O)NN/C=C\3/C=CC(=O)C=C3O)C4=CC=C(C=C4)OC

DOS

IR

Vibrations