Hydrogen bonding in nitroaniline analogues: a hydrogen-bonded chain of rings in 2-amino-4-butylamino-6-methoxy-5-nitropyrimidine

C  Glidewell; J N  Low; M  Melguizo; A  Quesada

doi:10.1107/S0108270102020991

Hydrogen bonding in nitroaniline analogues: a hydrogen-bonded chain of rings in 2-amino-4-butylamino-6-methoxy-5-nitropyrimidine

C Glidewell, J N Low, M Melguizo, A Quesada

School of Chemistry

Research output: Contribution to journal › Article › peer-review

Abstract

In the title compound, C9H15N5O3, in which the molecules exhibit orientational disorder, the molecules of the major component are linked by paired N-H...O hydrogen bonds [H...O = 2.37 and 2.39 Angstrom, N...O = 2.974 (3) and 3.011 (3) Angstrom, and N-H...O = 126 and 128degrees] to form a C(8)C(8)[R-2(2) (6)] chain of rings along [010]. The minor component (6.5% of the molecules) forms a similar chain running in the opposite direction.

Original language	English
Pages (from-to)	O19-O21
Number of pages	3
Journal	Acta Crystallographica Section C: Crystal Structure Communications
Volume	59
Issue number	1
DOIs	https://doi.org/10.1107/S0108270102020991
Publication status	Published - Jan 2003

Keywords

C-METHYLATED NITROANILINES
DIFFRACTION
CRYSTALS

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title = "Hydrogen bonding in nitroaniline analogues: a hydrogen-bonded chain of rings in 2-amino-4-butylamino-6-methoxy-5-nitropyrimidine",

abstract = "In the title compound, C9H15N5O3, in which the molecules exhibit orientational disorder, the molecules of the major component are linked by paired N-H...O hydrogen bonds [H...O = 2.37 and 2.39 Angstrom, N...O = 2.974 (3) and 3.011 (3) Angstrom, and N-H...O = 126 and 128degrees] to form a C(8)C(8)[R-2(2) (6)] chain of rings along [010]. The minor component (6.5% of the molecules) forms a similar chain running in the opposite direction.",

keywords = "C-METHYLATED NITROANILINES, DIFFRACTION, CRYSTALS",

author = "C Glidewell and Low, {J N} and M Melguizo and A Quesada",

year = "2003",

month = jan,

doi = "10.1107/S0108270102020991",

language = "English",

volume = "59",

pages = "O19--O21",

journal = "Acta Crystallographica Section C: Crystal Structure Communications",

issn = "0108-2701",

publisher = "International Union of Crystallography",

number = "1",

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TY - JOUR

T1 - Hydrogen bonding in nitroaniline analogues: a hydrogen-bonded chain of rings in 2-amino-4-butylamino-6-methoxy-5-nitropyrimidine

AU - Glidewell, C

AU - Low, J N

AU - Melguizo, M

AU - Quesada, A

PY - 2003/1

Y1 - 2003/1

N2 - In the title compound, C9H15N5O3, in which the molecules exhibit orientational disorder, the molecules of the major component are linked by paired N-H...O hydrogen bonds [H...O = 2.37 and 2.39 Angstrom, N...O = 2.974 (3) and 3.011 (3) Angstrom, and N-H...O = 126 and 128degrees] to form a C(8)C(8)[R-2(2) (6)] chain of rings along [010]. The minor component (6.5% of the molecules) forms a similar chain running in the opposite direction.

AB - In the title compound, C9H15N5O3, in which the molecules exhibit orientational disorder, the molecules of the major component are linked by paired N-H...O hydrogen bonds [H...O = 2.37 and 2.39 Angstrom, N...O = 2.974 (3) and 3.011 (3) Angstrom, and N-H...O = 126 and 128degrees] to form a C(8)C(8)[R-2(2) (6)] chain of rings along [010]. The minor component (6.5% of the molecules) forms a similar chain running in the opposite direction.

KW - C-METHYLATED NITROANILINES

KW - DIFFRACTION

KW - CRYSTALS

U2 - 10.1107/S0108270102020991

DO - 10.1107/S0108270102020991

M3 - Article

SN - 0108-2701

VL - 59

SP - O19-O21

JO - Acta Crystallographica Section C: Crystal Structure Communications

JF - Acta Crystallographica Section C: Crystal Structure Communications

IS - 1

ER -

Hydrogen bonding in nitroaniline analogues: a hydrogen-bonded chain of rings in 2-amino-4-butylamino-6-methoxy-5-nitropyrimidine

Abstract

Keywords

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