Chemical Data Processing Library C++ API - Version 1.1.1
Namespaces | Variables
CoordinationGeometry.hpp File Reference

Definition of constants in namespace CDPL::MolProp::CoordinationGeometry. More...

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Namespaces

 CDPL
 The namespace of the Chemical Data Processing Library.
 
 CDPL::MolProp
 Contains classes and functions related to the calculation/preciction of physicochemical molecular properties.
 
 CDPL::MolProp::CoordinationGeometry
 Provides constants used to specify the spatial geometry of atom arrangements around a common central atom.
 

Variables

const unsigned int CDPL::MolProp::CoordinationGeometry::UNDEF = 0
 Specifies undefined or unknown geometry. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::NONE = 1
 Specifies that a geometry cannot be assigned due to the lack of enough (>1) defining entities. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::LINEAR = 2
 Specifies linear geometry. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::TRIGONAL_PLANAR = 3
 Specifies trigonal planar geometry. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::TETRAHEDRAL = 4
 Specifies tetrahedral geometry. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::TRIGONAL_BIPYRAMIDAL = 5
 Specifies trigonal bipyramidal geometry. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::OCTAHEDRAL = 6
 Specifies octahedral geometry. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::PENTAGONAL_BIPYRAMIDAL = 7
 Specifies pentagonal bipyramidal geometry. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::SQUARE_ANTIPRISMATIC = 8
 Specifies square antiprismatic geometry. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::BENT = 9
 Specifies bent geometry. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::TRIGONAL_PYRAMIDAL = 10
 Specifies trigonal pyramidal geometry. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::SQUARE_PLANAR = 11
 Specifies square planar geometry. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::SQUARE_PYRAMIDAL = 12
 Specifies square pyramidal geometry. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::T_SHAPED = 13
 Specifies T-shaped geometry. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::SEESAW = 14
 Specifies seesaw geometry. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::PENTAGONAL_PYRAMIDAL = 15
 Specifies pentagonal pyramidal geometry. More...
 
const unsigned int CDPL::MolProp::CoordinationGeometry::PENTAGONAL_PLANAR = 16
 Specifies pentagonal planar geometry. More...
 

Detailed Description

Definition of constants in namespace CDPL::MolProp::CoordinationGeometry.