Formula Unicode styled:
[Zr(SO₃CF₃-κO)(NHPh)(Cp)₂] C,17,H,16,F,3,N,1,O,3,S,1,Zr,1 azanyl
Compound name(s):
Anilino-trifluoromethanesulfonato-zirconocene
Central atom:
Charge on formula unit (QN):
0
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:
1
[MLXZ]𝘲 class:
[MX1]
MLXZ class (ENC, equivalent neutral class):
MX1
Summary of calculated classifications:
H«V1C1OIE2B1Z0L0X1»
Geometry:
𝘥-electron configuration = 𝘮 – VN:
𝘥-electron configuration = 𝘮 – ON:
𝘥-electron configuration = 𝘮 – VN – 𝘲 from [MLXZ]𝘲:
Attached atoms:
N1
Phase:
InChIKey (see www.inchi-trust.org):
UTVJSYLGJISORG-UHFFFAOYSA-M
Formula Unicode generic:
[Zr(SO₃CF₃-κO)(NHPh)(Cp)₂] C,17,H,16,F,3,N,1,O,3,S,1,Zr,1 azanyl