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2,4-Bis(dimethylamino)-1,3,5-trimethyl-6-(nitrooxy)borazine

Journal Article · · Acta Crystallographica. Section E
 [1];  [2]
  1. Sandia National Lab. (SNL-NM), Albuquerque, NM (United States); DOE/OSTI
  2. Sandia National Lab. (SNL-NM), Albuquerque, NM (United States)
+ Show Author Affiliations

In the title compound, C7H21B3N6O3, the r.m.s. deviation of the borazine ring atoms is 0.019 Å. The dimethylamino groups are orientated at 41.80 (7) and 36.43 (7)° with respect to the borazine ring. The nitrooxy group is almost normal to the borazine ring [dihedral angle = 85.33 (14)°]. The methyl C atom trans to the NO3 group is displaced by 0.512 (3) Å from the ring plane, whereas the two ortho-methyl C atoms are displaced by 0.239 (3) and 0.178 (3) Å.

Research Organization:
Sandia National Laboratories, Albuquerque, NM (United States)
Sponsoring Organization:
USDOE Office of Science (SC), Basic Energy Sciences (BES). Chemical Sciences, Geosciences & Biosciences Division; USDOE National Nuclear Security Administration (NNSA)
Grant/Contract Number:
AC04-94AL85000
OSTI ID:
1628996
Journal Information:
Acta Crystallographica. Section E, Journal Name: Acta Crystallographica. Section E Journal Issue: 5 Vol. 69; ISSN 1600-5368; ISSN ACSEBH
Publisher:
International Union of CrystallographyCopyright Statement
Country of Publication:
United States
Language:
English

References (4)

Studies of Boron-Nitrogen Compounds. II. Preparation and Reactions of B-Trichloroborazole 1 journal December 1960
Mercury : visualization and analysis of crystal structures journal May 2006
A short history of SHELX journal December 2007
6-Chloro-2,4-bis(dimethylamino)-1,3,5-trimethylborazine journal January 2013

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