Geometry & MOs

Info

ID:

411967

PubChem CID:

135084823

Reduced:

BRhP2F4H52C56 (1)

Stoich.:

ABC2D4E52F56 (1)

Weight, g/mol:

529.418346

ΔHf, kcal/mol:

-10.98

Dipole, Da:

7.66

IP(EA), eV:

 -7.73(-2.55)

Spin(Sz, S2):

 None, None

Charge, e:

 -4

Chem-info

IUPAC name:

carbanide;cobalt;(1Z,5Z)-cycloocta-1,5-diene;ethane;3-(5-methyl-2-propan-2-ylcyclohexyl)-4,5,6,7-tetrahydro-1H-inden-1-ide

Drug info:

PubChemData

Smile

[B-](F)(F)(F)F.CC1=CC=C(C=C1)P(C2=C(C3=CC=CC=C3C=C2)C4=C(C=CC5=CC=CC=C45)P(C6=CC=C(C=C6)C)C7=CC=C(C=C7)C)C8=CC=C(C=C8)C.C1/C=C\CC/C=C\C1.[Rh]

DOS

IR

Vibrations