1-Butyl-2-Nitro-1-Nitrosoguanidine

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Properties Simple | Detailed

Formula C5H11N5O3
IUPAC Name 1-butyl-2-nitro-1-nitroso-guanidine
Molecular Mass 189.173 g·mol−1
Heat of Formation 24.6 ± 16.7 kJ·mol−1
Dipole Moment 4.42 ± 1.08 D
Volume 217.0 Å 3
Surface Area 215.64 Å 2
HOMO Energy -10.64 ± 0.55 eV
LUMO Energy 1.60 ± eV
Point Group Symmetry C1
Synonyms
  • 1-butyl-2-(dihydroxyamino)-1-nitroso-guanidine
  • 1-butyl-2-(dihydroxyamino)-1-nitrosoguanidine
  • 1-butyl-3-nitro-1-nitrosoguanidine
  • 1-nitroso-3-nitro-1-butylguanidine
  • 3-butyl-1-nitro-3-nitrosoguanidine
  • [[amino-(butyl-nitroso-amino)methylene]amino]-hydroxy-keto-ammonium
  • [[amino-(butyl-nitroso-amino)methylene]amino]-hydroxy-oxo-ammonium
  • [[amino-(butyl-nitroso-amino)methylidene]amino]-hydroxy-oxo-azanium
  • [[amino-(butyl-nitrosoamino)methylene]amino]-hydroxy-oxoammonium
  • [[amino-(butyl-nitrosoamino)methylidene]amino]-hydroxy-oxoazanium
  • guanidine, 1-butyl-3-nitro-1-nitroso-
  • guanidine, n-butyl-n'-nitro-n-nitroso-
  • n-butyl-n'-nitro-n-nitrosoguanidine
  • n-nitroso-n'-nitro-n-butylguanidine
CAS Number(s)
  • 13010-08-7
InChIKey FJNCPBNCTRDXFB-UHFFFAOYSA-N
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