D. B. Straus, N. Iotov, M. R. Gau, Q. Zhao, P. J. Carroll, and C. R. Kagan, Longer Cations Increase Energetic Disorder in Excitonic 2D Hybrid Perovskites, The Journal of Physical Chemistry Letters 10, 1198‑1205 (2019). doi: 10.1021/acs.jpclett.9b00247.

See all entries for this property (28 total)

Origin: experimental (T = 100.0 K)
Space group: P 1
Lattice parameters

Crystal system: triclinic

a:32.3872 Å
b:8.6856 Å
c:8.6863 Å
α:89.446°
β:85.276°
γ:85.236°
Fixed parameters:
  • temperature = 100.0 K
D. B. Straus, N. Iotov, M. R. Gau, Q. Zhao, P. J. Carroll, and C. R. Kagan, Longer Cations Increase Energetic Disorder in Excitonic 2D Hybrid Perovskites, The Journal of Physical Chemistry Letters 10, 1198‑1205 (2019). doi: 10.1021/acs.jpclett.9b00247.
System description
Dimensionality: D
Sample type: single crystal
Related data
This data set is directly linked to other data sets: See all related data

Starting materials: HI (Sigma Aldrich, 57% w/w), chloroform (Fisher, HPLC grade), tributylphosphate (Acros Organics, 99+%), PbI2 (Strem, 99.999+%), phenylethylamine (PEA, Sigma-Aldrich, >99.5%), diethyl ether (Fisher, ACS grade, anhydrous, stabilized with BHT)

Product: orange crystals

Description: 7 ml Unstabilized HI was treated with 10% v/v solution of tributylphosphate in chloroform. The aqueous phase (HI) was extracted. PbI2 (.231 g) was dissolved in the HI solution by heating to 100º C under N2 flow. In it, 0.13 ml PEA is added. The reaction is then cooled to room temperature, at a constant rate of 2 ºC/h. Then, the mixture is cooled at 4ºC for 30 minutes, filtered, washed with diethyl ether, and dried overnight under vacuum at 50 °C.

Method: Single crystal X-Ray Diffraction

Description: SCXRD data are collected on a Bruker Kappa APEX II DUO diffractometer with a CCD area detector employing graphite-monochromated Mo Kα radiation (λ = 0.710 73 Å). Crystals for SCXRD measured at 100 K are cooled by an Oxford Cryostream.

Extraction method: Manually extracted from a publication
Entry added on: July 30, 2020, 5:15 p.m.
Entry added by: Rebecca Lau Duke University
Last updated on: March 24, 2022, 8:15 p.m.
Last updated by: Rayan C Duke University

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Data set ID: 1533 Did you find any mistakes or inconsistencies about this data? Send us a note and we'll have a look at it and send you a reply. Thanks!

See all entries for this property (28 total)

Origin: experimental (T = 300.0 K)
Space group: P 1
Lattice parameters

Crystal system: triclinic

a:33.0253 Å
b:8.7437 Å
c:8.7437 Å
α:89.632°
β:84.6307°
γ:84.616°
Fixed parameters:
  • temperature = 300.0 K
D. B. Straus, N. Iotov, M. R. Gau, Q. Zhao, P. J. Carroll, and C. R. Kagan, Longer Cations Increase Energetic Disorder in Excitonic 2D Hybrid Perovskites, The Journal of Physical Chemistry Letters 10, 1198‑1205 (2019). doi: 10.1021/acs.jpclett.9b00247.
System description
Dimensionality: D
Sample type: single crystal
Related data
This data set is directly linked to other data sets: See all related data

Starting materials: HI (Sigma Aldrich, 57% w/w), chloroform (Fisher, HPLC grade), tributylphosphate (Acros Organics, 99+%), PbI2 (Strem, 99.999+%), phenylethylamine (PEA, Sigma-Aldrich, >99.5%), diethyl ether (Fisher, ACS grade, anhydrous, stabilized with BHT)

Product: orange crystals

Description: 7 ml Unstabilized HI was treated with 10% v/v solution of tributylphosphate in chloroform. The aqueous phase (HI) was extracted. PbI2 (.231 g) was dissolved in the HI solution by heating to 100º C under N2 flow. In it, 0.13 ml PEA is added. The reaction is then cooled to room temperature, at a constant rate of 2 ºC/h. Then, the mixture is cooled at 4ºC for 30 minutes, filtered, washed with diethyl ether, and dried overnight under vacuum at 50 °C.

Method: Single crystal X-Ray Diffraction

Description: SCXRD data are collected on a Bruker Kappa APEX II DUO diffractometer with a CCD area detector employing graphite-monochromated Mo Kα radiation (λ = 0.710 73 Å).

Extraction method: manually extracted from a publication
Entry added on: July 30, 2020, 5:20 p.m.
Entry added by: Rebecca Lau Duke University
Last updated on: March 28, 2022, 3:10 p.m.
Last updated by: Rayan C Duke University

Download data
Data set ID: 1534 Did you find any mistakes or inconsistencies about this data? Send us a note and we'll have a look at it and send you a reply. Thanks!


License

All data is available under the Creative Commons license with attribution clause, described here and, in its full text, here.