- InChI
- InChI=1S/C4H6N10/c1-13-3(7-9-11-13)5-6-4-8-10-12-14(4)2/h1-2H3/b6-5-
- InChI Key
- HOXMAHGFAGMFCJ-WAYWQWQTSA-N
- Formula
- C4H6N10
- SMILES
- Cn1nnnc1N=Nc1nnnn1C
- Molecular Weight1
- 194.16
- CAS
- 41463-69-8
- ω : Acentric Factor.
- ΔcH°solid : Standard solid enthalpy of combustion (kJ/mol).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfH°solid : Solid phase enthalpy of formation at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.7465 | Relay (... Calculated Property | |
| ΔcH°solid | -3186.20 ± 4.60 | kJ/mol | NIST |
| ΔfG° | 747.05 | kJ/mol | Relay (... Calculated Property ⚠️ |
| ΔfH°gas | 822.55 | kJ/mol | Relay (... Calculated Property |
| ΔfH°solid | 754.60 ± 4.60 | kJ/mol | NIST |
| ΔvapH° | 115.82 | kJ/mol | Relay (... Calculated Property |
| IE | 9.29 | eV | Relay (... Calculated Property |
| log10WS | -1.65 | Relay (... Calculated Property | |
| logPoct/wat | -0.851 | Crippen Calculated Property | |
| McVol | 123.800 | ml/mol | McGowan Calculated Property |
| Pc | 5863.44 | kPa | Relay (... Calculated Property ⚠️ |
| Tboil | 575.88 | K | Relay (... Calculated Property |
| Tc | 893.30 | K | Relay (... Calculated Property |
| Tfus | 497.72 | K | Relay (... Calculated Property |
| Vc | 0.555 | m3/kmol | Relay (... Calculated Property |
Similar Compounds
Find more compounds similar to cis-2,2'-Dimethyl-5,5'-azotetrazole.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) ⚠️ Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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