5-[Bis(2-Chloroethyl)Amino]-2,4-Dinitrobenzamide

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Properties Simple | Detailed

Formula C11H12Cl2N4O5
IUPAC Name 5-[bis(2-chloroethyl)amino]-2,4-dinitro-benzamide
Molecular Mass 351.143 g·mol−1
Heat of Formation -179.4 ± 16.7 kJ·mol−1
Dipole Moment 3.09 ± 1.08 D
Volume 362.18 Å 3
Surface Area 318.78 Å 2
HOMO Energy -10.42 ± 0.55 eV
LUMO Energy 0.48 ± eV
Point Group Symmetry C1
Synonyms
  • 5-(n,n-bis(2-chloroethyl)amino)-2,4-dinitrobenzamide
  • 5-[bis-2(chloro-ethyl)-amino]-2,4-dintro-benzamide
  • benzamide, 5-(bis(2-chloroethyl)amino-2,4-dinitro-
  • sn 23862
  • sn-23862
  • sn2
CAS Number(s)
  • 142439-61-0
InChIKey DQMALWRRERBILB-UHFFFAOYSA-N
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Elements H C N O Cl