2-Bromo-N-[(2-Bromoethylamino)-[(3-Methyl-2-Nitro-Imidazol-1-Ium-4-Id-4-Yl)Methoxy]Phosphoryl]Ethanamine

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Properties Simple | Detailed

Formula C9H17Br2N5O4P
IUPAC Name 2-bromo-n-[(2-bromoethylamino)-[(3-methyl-2-nitro-imidazol-1-ium-4-id-4-yl)methoxy]phosphoryl]ethanamine
Molecular Mass 450.044 g·mol−1
Heat of Formation -406.4 ± 16.7 kJ·mol−1
Dipole Moment 9.69 ± 1.08 D
Volume 400.45 Å 3
Surface Area 338.24 Å 2
HOMO Energy -9.58 ± 0.55 eV
LUMO Energy -0.82 ± eV
Point Group Symmetry C1
InChIKey SFTQHXSVNBEIRF-UHFFFAOYSA-N
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Elements C H O N P Br