ISDA: 5O5W

Structural Complex

Chemical ID: M10

IUPAC Name: (mu3-oxo)-tris(mu2-oxo)-nonakisoxo-trimolybdenum (VI)

Formal Charge: ?

Type: NON-POLYMER

Physiochemical Descriptor:

Formula: Mo3 O13

Molecular weight: 495.812

Hydrogen Bond Acceptor:

Hydrogen Bond Donor:

Rotatable Bonds:

Heavy Atoms:

Systematic name

Program	Version	Descriptor

Chemical Descriptors

Type	Program	Version	Descriptor
InChI	InChI	1.03	InChI=1S/3Mo.13O/q;;;;;;;;8*-1
InChIKey	InChI	1.03	HGNGIYFURFJYFJ-UHFFFAOYSA-N
SMILES_CANONICAL	CACTVS	3.370	[O-][Mo]\|12([O-])([O-])O[Mo]3([O-])([O-])([O-])O\|1[Mo]([O-])([O-])(=O)(O2)O3
SMILES	CACTVS	3.370	[O-][Mo]\|12([O-])([O-])O[Mo]3([O-])([O-])([O-])O\|1[Mo]([O-])([O-])(=O)(O2)O3
SMILES_CANONICAL	OpenEye OEToolkits	1.7.6	[O-][Mo]12(O[Mo]3(O1[Mo](=O)(O2)(O3)([O-])[O-])([O-])([O-])[O-])([O-])[O-]
SMILES	OpenEye OEToolkits	1.7.6	[O-][Mo]12(O[Mo]3(O1[Mo](=O)(O2)(O3)([O-])[O-])([O-])([O-])[O-])([O-])[O-]