(4Z)-4-[3,3-Bis(2-Chloroethyl)Triazanylidene]-4H-Imidazole-5-Carboxamide

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Properties Simple | Detailed

Formula C8H12Cl2N6O
IUPAC Name (5z)-5-[bis(2-chloroethyl)aminohydrazono]imidazole-4-carboxamide
Molecular Mass 279.126 g·mol−1
Heat of Formation 210.5 ± 16.7 kJ·mol−1
Dipole Moment 5.12 ± 1.08 D
Volume 309.9 Å 3
Surface Area 285.62 Å 2
HOMO Energy -10.28 ± 0.55 eV
LUMO Energy -2.26 ± eV
Point Group Symmetry C1
Synonyms
  • (5z)-5-[bis(2-chloroethyl)aminohydrazinylidene]imidazole-4-carboxamide
  • (5z)-5-[bis(2-chloroethyl)aminohydrazono]-4-imidazolecarboxamide
  • (5z)-5-[bis(2-chloroethyl)aminohydrazono]imidazole-4-carboxamide
  • 1h-imidazole-4-carboxamide, 5-[3,3-bis(2-chloroethyl)-1-triazenyl]-
  • 5-[3,3-bis(2-chloroethyl)-1-triazeno]-imidazole-4-carboxamide
  • 5-[3,3-bis(2-chloroethyl)-1-triazeno]imidazole-4-carboxamide
  • 5-[bis(2-chloroethyl)aminohydrazinylidene]imidazole-4-carboxamide
  • 5-[bis(2-chloroethyl)aminohydrazono]-4-imidazolecarboxamide
  • 5-[bis(2-chloroethyl)aminohydrazono]imidazole-4-carboxamide
  • carboxamide, 5(or 4)-3,3-bis(2-chloroethyl)-triazenoimidazole-4(or 5)-
  • ic(hn2)t
  • imidazole mustard
  • imidazole-4(or 5)-carboxamide, 5(or 4)-[3,3-bis(2-chloroethyl)-1-triazeno]-
  • imidazole-4-carboxamide, 5-[3,3-bis(2-chloroethyl)-1-triazeno]-
  • sri 2489
  • tic mustard
CAS Number(s)
  • 5034-77-5
InChIKey LJBPZXANEYTOEF-ZSOIEALJSA-N
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