Three polymorphs (α, β and δ) of D-mannitol at 100 K

被引:72
作者
Fronczek, FR [1 ]
Kamel, HN
Slattery, M
机构
[1] Louisiana State Univ, Dept Chem, Baton Rouge, LA 70803 USA
[2] Univ Mississippi, Dept Pharmacognosy, University, MS 38677 USA
来源
ACTA CRYSTALLOGRAPHICA SECTION C-STRUCTURAL CHEMISTRY | 2003年 / 59卷
关键词
D O I
10.1107/S0108270103018961
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
In the monoclinic delta polymorph of D-mannitol, C6H14O6, both the molecule and the packing have approximate twofold rotational symmetry. The P2(1) structure thus approximates space group C222(1), and the alpha' polymorph, previously reported in that space group, is almost certainly identical to the delta polymorph. However, torsion angles along the main backbone of the molecule deviate from twofold symmetry by as much as 7.4 (3)degrees and the hydrogen-bonding pattern does not conform to the higher symmetry. The alpha polymorph reported here is identical to the previously reported kappa polymorph, and the low-temperature structure of the beta polymorph agrees well with previously reported room-temperature determinations. The range of C-O bond lengths over the three polymorphs is 1.428 (2)-1.437 (4) Angstrom, and the range of C-C distances is 1.515 (4)-1.5406 (19) Angstrom. The delta polymorph has the highest density of the three, both at room temperature and at 100 K.
引用
收藏
页码:O567 / O570
页数:4
相关论文
共 19 条
[1]   SIR97:: a new tool for crystal structure determination and refinement [J].
Altomare, A ;
Burla, MC ;
Camalli, M ;
Cascarano, GL ;
Giacovazzo, C ;
Guagliardi, A ;
Moliterni, AGG ;
Polidori, G ;
Spagna, R .
JOURNAL OF APPLIED CRYSTALLOGRAPHY, 1999, 32 :115-119
[2]   CRYSTAL STRUCTURES OF ALPHA' AND BETA FORMS OF D-MANNITOL [J].
BERMAN, HM ;
JEFFREY, GA ;
ROSENSTEIN, RD .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL CRYSTALLOGRAPHY AND CRYSTAL CHEMISTRY, 1968, B 24 :442-+
[3]  
Bernstein J., 2002, POLYMORPHISM MOL CRY
[4]  
Burger A, 2000, J PHARM SCI-US, V89, P457, DOI 10.1002/(SICI)1520-6017(200004)89:4<457::AID-JPS3>3.0.CO
[5]  
2-G
[7]   TOWARDS UNDERSTANDING C-13-NMR CHEMICAL-SHIFTS OF CARBOHYDRATES IN THE SOLID-STATE - THE SPECTRA OF D-MANNITOL POLYMORPHS AND OF DL-MANNITOL [J].
GRINDLEY, TB ;
MCKINNON, MS ;
WASYLISHEN, RE .
CARBOHYDRATE RESEARCH, 1990, 197 :41-52
[8]  
GROTH P, 1910, CHEM KRYSTALLOGRAPHI, V3, P431
[9]   Crystal optics of D-mannitol, C6H14O6: Crystal growth, structure, basic physical properties, birefringence, optical activity, Faraday effect, electro-optic effects and model calculations [J].
Kaminsky, W ;
Glazer, AM .
ZEITSCHRIFT FUR KRISTALLOGRAPHIE, 1997, 212 (04) :283-296
[10]   CRYSTAL AND MOLECULAR-STRUCTURE OF D-L-MANNITOL AT -150-DEGREES-C [J].
KANTERS, JA ;
ROELOFSEN, G ;
SMITS, D .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE CRYSTAL ENGINEERING AND MATERIALS, 1977, 33 (DEC) :3635-3640