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Calcium Tin Oxide (Casno3)
CAS: 12013-46-6 | CaOSn
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
12013-46-6
Molecular Formula:
CaOSn
Molecular Mass:
174.79 g/mol
Names and Synonyms:
Calcium Tin Oxide (Casno3)
Calcium tin oxide (CaSnO3)
Calcium stannate(IV) (CaSnO3)
Stannate (SnO32-), calcium (1:1)
Tin calcium oxide (SnCaO3)
Calcium tin trioxide
Calcium stannate (CaSnO3)
Calcium tin oxide
Tin calcium oxide
Calcium stannate
CAF 03PB
Identifiers:
SMILES:
[Ca].[O].[Sn]
InChI:
InChI=1S/Ca.O.Sn
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 174.79 g/mol | CAS Common Chemistry |
| 174.788 g/mol | RDKit | |
| 175.8597003 g/mol | RDKit | |
| Canonical SMILES | [O].[Ca].[Sn] | CAS Common Chemistry |
| InChI | InChI=1S/Ca.O.Sn | CAS Common Chemistry |
| InChI Key | InChIKey=CFNRFAOSCIVDQM-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Calcium tin oxide (CaSnO3) | CAS Common Chemistry |
| Heavy Atom Count | 3 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 28.5 Ų | RDKit |
| LogP | -0.8804000000000001 | RDKit |
| Molar Refractivity | 12.194499999999998 | RDKit |
