N-[(5-Isocyanato-8-Nitro-Tetralin-6-Yl)Methyl]Hydroxylamine

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Properties Simple | Detailed

Formula C12H14N3O4+
IUPAC Name n-[(5-isocyanato-8-nitro-tetralin-6-yl)methyl]hydroxylamine
Molecular Mass 264.257 g·mol−1
Heat of Formation 12.2 ± 16.7 kJ·mol−1
Dipole Moment 2.39 ± 1.08 D
Volume 282.16 Å 3
Surface Area 259.53 Å 2
HOMO Energy -9.52 ± 0.55 eV
LUMO Energy 2.55 ± eV
Point Group Symmetry C1
InChIKey KGRSRSGGSHNBPE-UHFFFAOYSA-O
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