fac–[Ni([9]aneN₃-κ³N)([9]aneS₃-κ³S)]²⊕

Formula Unicode styled:

Compound name(s):

(1,4,7-Triazacyclononane)-(1,4,7-trithiacyclononane)-nickel(2+)

Central atom:

Charge on formula unit (QN):

Attached groups:

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:

[MLXZ]𝘲 class:

[ML₆]²⁺

MLXZ class (ENC, equivalent neutral class):

MX₂L₄

Summary of calculated classifications:

Ni«V²C⁶O^IIE²⁰B⁶Z⁰X⁰L⁶»^2⊕

Geometry:

Isomer label:

𝘥-electron configuration = 𝘮 – VN:

d⁸

𝘥-electron configuration = 𝘮 – ON:

d⁸

𝘥-electron configuration = 𝘮 – VN – 𝘲 from [MLXZ]𝘲:

d⁸

Attached atoms:

N₃S₃

Phase:

InChIKey (see www.inchi-trust.org):

YFIOILJYIMAIGY-UHFFFAOYSA-N