Formula Unicode styled:
[Ir(S₂C₆H₄-κ²S)(Cp*)]⊕
Compound name(s):
(Benzene-1,2-dithiolato)-(η⁵-pentamethyl-cyclopentadienyl)-iridium
Central atom:
Charge on formula unit (QN):
1+
Compound type:
DOI link to literature report:
Crystal data CSD link:
Crystal data ICSD link:
Valence Number (VN) = 𝘹 + 2𝘻 :
Coordination Number (CN, sum of attached group denticities):
Oxidation Number (ON) (Roman numerals):
Electron Number (EN) = 𝘮 + 𝘹 +2𝘭:
Bond number (BN) = 𝘹 + 𝘭 + 𝘻:
5
[MLXZ]𝘲 class:
[MX3L2]+
MLXZ class (ENC, equivalent neutral class):
MX4L1
Summary of calculated classifications:
Ir«V4C5OIVE15B5Z0X3L2»⊕
Geometry:
𝘥-electron configuration = 𝘮 – VN:
d5
𝘥-electron configuration = 𝘮 – ON:
d5
𝘥-electron configuration = 𝘮 – VN – 𝘲 from [MLXZ]𝘲:
d5
Attached atoms:
C5S2
Phase:
InChIKey (see www.inchi-trust.org):
UJIFOSYVSJOBDW-UHFFFAOYSA-L