MOLECULAR CO-CRYSTALS OF CARBOXYLIC-ACIDS .10. STRUCTURE OF THE 1-1 ADDUCT OF TRIPHENYLPHOSPHINE OXIDE WITH (PENTACHLOROPHENOXY)ACETIC ACID

被引：13

作者：

LYNCH, DE

SMITH, G

BYRIEL, KA

KENNARD, CHL

机构：

[1] QUEENSLAND UNIV TECHNOL,SCH CHEM,POB 2434,BRISBANE,QLD 4001,AUSTRALIA

[2] UNIV QUEENSLAND,DEPT CHEM,BRISBANE,QLD 4072,AUSTRALIA

来源：

ACTA CRYSTALLOGRAPHICA SECTION C-CRYSTAL STRUCTURE COMMUNICATIONS | 1993年 / 49卷

关键词：

D O I：

10.1107/S0108270192005572

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

C18H15OP.C8H3Cl5O3, M(r) = 602.7, triclinic, P1BAR, a = 10.185 (6), b = 12.036 (5), c = 12.194 (6) angstrom, alpha = 92.21 (3), beta = 108.48 (3), gamma = 106.10 (3)degrees, V = 1349 (1) angstrom3, Z = 2, D(x) = 1.483 Mg m-3, lambda(Mo Kalpha) = 0.71073 angstrom, mu = 0.63 mm-1, F(000) = 612, T = 295 K, R = 0.041 for 3317 observed reflections. The compound was prepared by interacting a 1:1 molar ratio of triphenylphosphine oxide and (pentachlorophenoxy)acetic acid in toluene/ethanol and allowing the mixture to evaporate to dryness. The two organic molecules associate through a single directed hydrogen bond between the carboxylic acid group and the phosphoryl O atom [OH...O 2.541 (4) angstrom].

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收藏

页码：285 / 288

页数：4

相关论文

共 14 条

[1] CRYSTAL AND MOLECULAR STRUCTURE OF TRIPHENYLPHOSPHINE OXIDE [J].

BANDOLI, G ;

BORTOLOZZO, G ;

CLEMENTE, DA ;

CROATTO, U ;

PANATTON.C .

JOURNAL OF THE CHEMICAL SOCIETY A -INORGANIC PHYSICAL THEORETICAL, 1970, (17) :2778-+

[2] MOLECULAR COCRYSTALS OF CARBOXYLIC-ACIDS .9. CARBOXYLIC-ACID INTERACTIONS WITH ORGANIC HETEROCYCLIC BASES - THE CRYSTAL-STRUCTURES OF THE ADDUCTS OF (2,4-DICHLOROPHENOXY)ACETIC ACID WITH 3-HYDROXYPYRIDINE, 2,4,6-TRINITROBENZOIC ACID WITH 2-AMINOPYRIMIDINE, AND 4-NITROBENZOIC ACID WITH 3-AMINO-1,2,4-TRIAZOLE [J].

BYRIEL, KA ;

KENNARD, CHL ;

LYNCH, DE ;

SMITH, G ;

THOMPSON, JG .

AUSTRALIAN JOURNAL OF CHEMISTRY, 1992, 45 (06) :969-981

[3] ENCODING AND DECODING HYDROGEN-BOND PATTERNS OF ORGANIC-COMPOUNDS [J].

ETTER, MC .

ACCOUNTS OF CHEMICAL RESEARCH, 1990, 23 (04) :120-126

[4] TRIPHENYLPHOSPHINE OXIDE AS A CRYSTALLIZATION AID [J].

ETTER, MC ;

BAURES, PW .

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1988, 110 (02) :639-640

[5] STRUCTURAL ASPECTS OF PHENOXYALKANOIC ACIDS - THE STRUCTURES OF PHENOXYACETIC ACID, (+/-)-2-PHENOXYPROPIONIC ACID, (+/-)-2-(4-CHLOROPHENOXY)PROPIONIC ACID, 2-METHYL-2-PHENOXYPROPIONIC ACID AND 2-(4-CHLOROPHENOXY)-2-METHYLPROPIONIC ACID [J].

KENNARD, CHL ;

SMITH, G ;

WHITE, AH .

ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 1982, 38 (MAR) :868-875

[6] THE (1/1) ADDUCTS OF (2,4-DICHLOROPHENOXY)ACETIC ACID WITH 4-AMINOBENZOIC ACID AND TRIPHENYLPHOSPHINE OXIDE [J].

LYNCH, DE ;

SMITH, G ;

BYRIEL, KA ;

KENNARD, CHL .

ZEITSCHRIFT FUR KRISTALLOGRAPHIE, 1992, 200 (1-2) :73-82

[7] MOLECULAR COCRYSTALS OF CARBOXYLIC-ACIDS .6. THE CRYSTAL-STRUCTURES OF THE ADDUCTS OF TRIPHENYL-PHOSPHINE OXIDE WITH BENZENE-1,3,5-TRICARBOXYLIC ACID AND (2,4,5-TRICHLOROPHENOXY)ACETIC ACID [J].

LYNCH, DE ;

SMITH, G ;

BYRIEL, KA ;

KENNARD, CHL .

AUSTRALIAN JOURNAL OF CHEMISTRY, 1992, 45 (05) :835-844

[8]

Ruban G., 1976, CRYST STRUCT COMMUN, V6, P671

[9]

Sheldrick G.M., 1986, SHELXS86 PROGRAM SOL

[10]

SHELDRICK GM, 1976, SHELX PROGRAM CRYSTA