Inorganic Solid Phases

RbCN3H4 (Rb[CN3H4], T = 10 K) Crystal Structure

General Information

  • Phase Label(s): Rb[CN3H4]
  • Structure Class(es):
  • Classification by Properties:
  • Mineral Name(s):
  • Pearson Symbol: oP20
  • Space Group: 62
  • Phase Prototype: Rb[CN3H4]
  • Measurement Detail(s): automatic diffractometer (determination of cell parameters), automatic diffractometer; STOE STADI 2/PL (determination of structural parameters), X-rays, Cu Kα1; λ = 0.154056 nm (determination of cell and structural parameters), T = 10 K (determination of cell and structural parameters)
  • Phase Class(es):
  • Compound Class(es): guanidinate
  • Interpretation Detail(s): complete structure determined; temperature dependence studied, Rietveld refinement, multiphase; 26 variables; 223 reflections, RP = 0.0542; RB = 0.0374
  • Sample Detail(s): sample prepared from RbH, CN3H5, amounts of RbOH[H2O] (3 wt.%), powder (determination of cell and structural parameters)

Substance Summary

  • Standard Formula: Rb[CN3H4]
  • Alphabetic Formula: [CN3H4]Rb
  • Published Formula: RbCN3H4
  • Refined Formula: CH4N3Rb
  • Wyckoff Sequence: 62,dc3
  • Z Formula Units: 4
  • Density: ρ = 2.61 Mg·m−3

Crystallographic Data

Cell Parameters

Published Data
Standardized Data
Unit Cell
Niggli-Reduced Cell
Space Group
a
b
c
α
β
γ
a/b
b/c
c/a
V

Atom Coordinates

Standardized

Site
Element
Wyckoff Symbol
Symmetry
X
Y
Z
Occupation
Co-ord. No.
Atomic Env.

Published

Site
Element
Wyckoff Symbol
Symmetry
X
Y
Z
Occupation

Displacement Parameters

Isotropic

Site
Published
U [nm2]
Type
Computed
Beq [nm2]

Experimental Details

Reference

3D Interactive Structure

About this content

  • Database name

    PAULING FILE Multinaries Edition – 2012

  • Dataset ID

    sd_1632821

  • Copyright

    ©Springer & Material Phases Data System (MPDS), Switzerland & National Institute for Materials Science (NIMS), Japan, 2016

  • Chief Editor

    Pierre Villars, Material Phases Data System (MPDS), CH-6354 Vitznau, Switzerland

    villars.mpds@bluewin.ch

  • Credits

    SpringerMaterials Release 2016.

    Data generated pre-2002: © Springer & MPDS & NIMS; post-2001: © Springer & MPDS

    All Rights Reserved. Version 2016.10.

    Project Coordinator: Shuichi Iwata

    Section-Editor: Karin Cenzual (Crystal Structures)

  • Cite this content

    Citation copied