ISDA: 6H8B

Structural Complex

Chemical ID: J7N

IUPAC Name: 2,2,4-tris(oxidanyl)-1,3-dioxa-2$l^{4},4$l^{3}-dimolybdacyclobutane

Formal Charge: ?

Type: NON-POLYMER

Physiochemical Descriptor:

Formula: H3 Mo2 O5

Molecular weight: 274.901

Hydrogen Bond Acceptor: 3

Hydrogen Bond Donor: 0

Rotatable Bonds: 0

Heavy Atoms: 7

Systematic name

Program	Version	Descriptor
OpenEye OEToolkits	2.0.7	2,2,4-tris(oxidanyl)-1,3-dioxa-2$l^{4},4$l^{3}-dimolybdacyclobutane

Chemical Descriptors

Type	Program	Version	Descriptor
InChI	InChI	1.03	InChI=1S/2Mo.3H2O.2O/h;;3*1H2;;/q+1;+2;;;;;/p-3
InChIKey	InChI	1.03	AUVZZTGQIKYYRK-UHFFFAOYSA-K
SMILES_CANONICAL	CACTVS	3.385	O[Mo]1O[Mo](O)(O)O1
SMILES	CACTVS	3.385	O[Mo]1O[Mo](O)(O)O1
SMILES_CANONICAL	OpenEye OEToolkits	2.0.7	O[Mo]1O[Mo](O1)(O)O
SMILES	OpenEye OEToolkits	2.0.7	O[Mo]1O[Mo](O1)(O)O