Structural Complex
Chemical ID: UWE
IUPAC Name: $l^{3}-oxidanylidynemethylnickel
Formal Charge: ?
Type: non-polymer
Physiochemical Descriptor:
Formula: C Ni O
Molecular weight: 86.703
Hydrogen Bond Acceptor: 0
Hydrogen Bond Donor: 0
Rotatable Bonds: 0
Heavy Atoms: 3
Systematic name
Program Version Descriptor
ACDLabs 14.52 (carbonyl-kappaC)nickel(1+)
OpenEye OEToolkits 3.1.0.0 oxidaniumylidynemethylnickel
Chemical Descriptors
Type Program Version Descriptor
SMILES ACDLabs 14.52 [O+]#C[Ni]
InChI InChI 1.06 InChI=1S/CO.Ni/c1-2;/q+1;
InChIKey InChI 1.06 IBXNIJKRMDYAOR-UHFFFAOYSA-N
SMILES_CANONICAL CACTVS 3.385 [Ni]C#[O+]
SMILES CACTVS 3.385 [Ni]C#[O+]
SMILES_CANONICAL OpenEye OEToolkits 3.1.0.0 C(#[O+])[Ni]
SMILES OpenEye OEToolkits 3.1.0.0 C(#[O+])[Ni]
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