MANGANESE AMMONIUM PYROPHOSPHATE
General Information
| Mainterm | MANGANESE AMMONIUM PYROPHOSPHATE |
| CAS Reg.No.(or other ID) | 10101-66-3 |
| Regnum |
178.3297 |
From www.fda.gov
Computed Descriptors
Download SDF| 2D Structure | |
| CID | 160915 |
| IUPAC Name | azanium;manganese(3+);phosphonato phosphate |
| InChI | InChI=1S/Mn.H3N.H4O7P2/c;;1-8(2,3)7-9(4,5)6/h;1H3;(H2,1,2,3)(H2,4,5,6)/q+3;;/p-3 |
| InChI Key | UHHXUPJJDHEMGX-UHFFFAOYSA-K |
| Canonical SMILES | [NH4+].[O-]P(=O)([O-])OP(=O)([O-])[O-].[Mn+3] |
| Molecular Formula | H4MnNO7P2 |
| Wikipedia | manganese violet |
From Pubchem
Computed Properties
| Property Name | Property Value |
|---|---|
| Molecular Weight | 246.918 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 7 |
| Rotatable Bond Count | 0 |
| Complexity | 124.0 |
| CACTVS Substructure Key Fingerprint | A A A D c Y A C O A M A A A B A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A Q A C A A A A A A A A A A A A A A A B A A Q A A A A I A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A = = |
| Topological Polar Surface Area | 137.0 |
| Monoisotopic Mass | 246.884 |
| Exact Mass | 246.884 |
| Compound Is Canonicalized | True |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Isotope Atom Count | 0 |
| Covalently-Bonded Unit Count | 3 |
From Pubchem