CoordinationGeometry.hpp File Reference

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

Go to the source code of this file.

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

Detailed Description

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