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Table 1 Selected crystallographic data for triamterene

From: Using crystallography, topology and graph set analysis for the description of the hydrogen bond network of triamterene: a rational approach to solid form selection

 

FITZAJ

FITZAJ01

This work [CCDC: 1532364]

Crystal morphology

Colourless platelets

Yellow block

Yellow block

Data collection temperature (K)

291 (2)

173 (2)

180 (2)

Radiation

Cu (1.54178 Å)

Mo (0.71073 Å)

Cu (1.54178 Å)

Crystal system

Triclinic

Triclinic

Triclinic

Space group

PĪ

PĪ

PĪ

a (Ã…)

7.440 (1)

7.4659 (8)

7.4432 (15)

b (Ã…)

10.164 (1)

10.0257 (12)

9.993 (2)

c (Ã…)

16.666 (2)

16.7147 (19)

16.648 (3)

α (°)

77.43 (1)

77.579 (9)

77.55 (2)

β (°)

88.75 (1)

87.490 (9)

87.54 (3)

γ (°)

88.56 (1)

86.937 (9)

87.09 (3)

Volume (Ã…3)

1229.5

1219.4 (2)

1207.0 (4)

No. of reflections used

4251

4567

4571

No. of observed reflections

3186

[F o  > 3sig*]

3300

[I > 2sig(I)]

3786

[I > 2sig(I)]

Z, Z′

4, 2

4, 2

4, 2

R 1 factor

0.090

0.0739

0.0360

Calculated density (g/cm3)

1.37

1.380

1.394

Packing coefficient

67.8

67.3

68.0