1-(2-Chloroethyl)-1-Nitroso-3-[(1-Oxido-3-Pyridinyl)Methyl]Urea

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Properties Simple | Detailed

Formula C9H11ClN4O3
IUPAC Name 1-(2-chloroethyl)-1-nitroso-3-[(1-oxidopyridin-1-ium-3-yl)methyl]urea
Molecular Mass 258.662 g·mol−1
Heat of Formation -103.7 ± 16.7 kJ·mol−1
Dipole Moment 6.37 ± 1.08 D
Volume 284.57 Å 3
Surface Area 263.81 Å 2
HOMO Energy -9.30 ± 0.55 eV
LUMO Energy 2.00 ± eV
Point Group Symmetry C1
InChIKey AHRARYLCXQHBBJ-UHFFFAOYSA-N
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Elements H C N O Cl