Geometry & MOs

Info

ID:

400348

PubChem CID:

135047637

Reduced:

ClTcH5C7 (1)

Stoich.:

ABC5D7 (1)

Weight, g/mol:

356.071579

ΔHf, kcal/mol:

160.44

Dipole, Da:

5.14

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 1.981938

Charge, e:

0

Chem-info

IUPAC name:

carbon monoxide;chromium;1-[(R)-methoxy-[(E)-pent-3-enoxy]methyl]-2-methylbenzene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C#[Tc]Cl

DOS

IR

Vibrations