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Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology |
You are here: Experimental > One molecule all properties |
Other names |
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Tin tetrahydride; |
INChI | INChIKey | SMILES | IUPAC name |
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InChI=1S/Sn.4H | [SnH4] |
State | Conformation |
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1A1 | TD |
Property | Value | Uncertainty | units | Reference | Comment |
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Mode Number | Symmetry | Frequency | Intensity | Comment | Description | ||||
---|---|---|---|---|---|---|---|---|---|
Fundamental(cm-1) | Harmonic(cm-1) | Reference | (km mol-1) | unc. | Reference | ||||
1 | A1 | 1908 | 1976Arm/Cla:11-21 | ||||||
2 | E | 753 | |||||||
3 | T2 | 1905 | |||||||
4 | T2 | 681 |
A | B | C | reference | comment |
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Product of moments of inertia ![]() | ||||
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amu3Å6 | 0 | gm3 cm6 |
Point Group Td
Description | Value | unc. | Connectivity | Reference | Comment | |||
---|---|---|---|---|---|---|---|---|
Atom 1 | Atom 2 | Atom 3 | Atom 4 |
Atom | x (Å) | y (Å) | z (Å) |
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Bond descriptions
Bond Type | Count |
---|---|
H-Sn | 4 |
Energy (cm-1) | Degeneracy | reference | description |
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State | Config | State description | Conf description | Exp. min. | Dipole (Debye) | Reference | comment | Point Group | Components | ||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
x | y | z | total | dipole | quadrupole | ||||||||
1 | 1 | 1A1 | Td | True | Td | 0 | 0 |
State | Config | State description | Conf description | Exp. min. | Quadrupole (D Å) | Reference | comment | Point Group | Components | |||
---|---|---|---|---|---|---|---|---|---|---|---|---|
xx | yy | zz | dipole | quadrupole | ||||||||
1 | 1 | 1A1 | Td | True | Td | 0 | 0 |
squib | reference | DOI |
---|---|---|
1976Arm/Cla:11-21 | RS Armstrong, RJH Clark "Vapour Phase Raman Spectra of the Molecules MH4, (M = C, Si, Ge or Sn) and MF4, (M = C, Si or Ge)" J. Chem. Soc., Faraday Trans. 2, 1976,72, 11-21 | 10.1039/F29767200011 |
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