Chemical Data Processing Library C++ API - Version 1.1.1
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Provides constants used to specify the spatial geometry of atom arrangements around a common central atom. More...
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const unsigned int | UNDEF = 0 |
Specifies undefined or unknown geometry. More... | |
const unsigned int | NONE = 1 |
Specifies that a geometry cannot be assigned due to the lack of enough (>1) defining entities. More... | |
const unsigned int | LINEAR = 2 |
Specifies linear geometry. More... | |
const unsigned int | TRIGONAL_PLANAR = 3 |
Specifies trigonal planar geometry. More... | |
const unsigned int | TETRAHEDRAL = 4 |
Specifies tetrahedral geometry. More... | |
const unsigned int | TRIGONAL_BIPYRAMIDAL = 5 |
Specifies trigonal bipyramidal geometry. More... | |
const unsigned int | OCTAHEDRAL = 6 |
Specifies octahedral geometry. More... | |
const unsigned int | PENTAGONAL_BIPYRAMIDAL = 7 |
Specifies pentagonal bipyramidal geometry. More... | |
const unsigned int | SQUARE_ANTIPRISMATIC = 8 |
Specifies square antiprismatic geometry. More... | |
const unsigned int | BENT = 9 |
Specifies bent geometry. More... | |
const unsigned int | TRIGONAL_PYRAMIDAL = 10 |
Specifies trigonal pyramidal geometry. More... | |
const unsigned int | SQUARE_PLANAR = 11 |
Specifies square planar geometry. More... | |
const unsigned int | SQUARE_PYRAMIDAL = 12 |
Specifies square pyramidal geometry. More... | |
const unsigned int | T_SHAPED = 13 |
Specifies T-shaped geometry. More... | |
const unsigned int | SEESAW = 14 |
Specifies seesaw geometry. More... | |
const unsigned int | PENTAGONAL_PYRAMIDAL = 15 |
Specifies pentagonal pyramidal geometry. More... | |
const unsigned int | PENTAGONAL_PLANAR = 16 |
Specifies pentagonal planar geometry. More... | |
Provides constants used to specify the spatial geometry of atom arrangements around a common central atom.
const unsigned int CDPL::MolProp::CoordinationGeometry::UNDEF = 0 |
Specifies undefined or unknown geometry.
const unsigned int CDPL::MolProp::CoordinationGeometry::NONE = 1 |
Specifies that a geometry cannot be assigned due to the lack of enough (>1) defining entities.
const unsigned int CDPL::MolProp::CoordinationGeometry::LINEAR = 2 |
Specifies linear geometry.
const unsigned int CDPL::MolProp::CoordinationGeometry::TRIGONAL_PLANAR = 3 |
Specifies trigonal planar geometry.
const unsigned int CDPL::MolProp::CoordinationGeometry::TETRAHEDRAL = 4 |
Specifies tetrahedral geometry.
const unsigned int CDPL::MolProp::CoordinationGeometry::TRIGONAL_BIPYRAMIDAL = 5 |
Specifies trigonal bipyramidal geometry.
const unsigned int CDPL::MolProp::CoordinationGeometry::OCTAHEDRAL = 6 |
Specifies octahedral geometry.
const unsigned int CDPL::MolProp::CoordinationGeometry::PENTAGONAL_BIPYRAMIDAL = 7 |
Specifies pentagonal bipyramidal geometry.
const unsigned int CDPL::MolProp::CoordinationGeometry::SQUARE_ANTIPRISMATIC = 8 |
Specifies square antiprismatic geometry.
const unsigned int CDPL::MolProp::CoordinationGeometry::BENT = 9 |
Specifies bent geometry.
const unsigned int CDPL::MolProp::CoordinationGeometry::TRIGONAL_PYRAMIDAL = 10 |
Specifies trigonal pyramidal geometry.
const unsigned int CDPL::MolProp::CoordinationGeometry::SQUARE_PLANAR = 11 |
Specifies square planar geometry.
const unsigned int CDPL::MolProp::CoordinationGeometry::SQUARE_PYRAMIDAL = 12 |
Specifies square pyramidal geometry.
const unsigned int CDPL::MolProp::CoordinationGeometry::T_SHAPED = 13 |
Specifies T-shaped geometry.
const unsigned int CDPL::MolProp::CoordinationGeometry::SEESAW = 14 |
Specifies seesaw geometry.
const unsigned int CDPL::MolProp::CoordinationGeometry::PENTAGONAL_PYRAMIDAL = 15 |
Specifies pentagonal pyramidal geometry.
const unsigned int CDPL::MolProp::CoordinationGeometry::PENTAGONAL_PLANAR = 16 |
Specifies pentagonal planar geometry.