1-Nitroso-4-Benzoyl-3,5-Dimethylpiperazine

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Properties Simple | Detailed

Formula C13H17N3O2
IUPAC Name [(2s,6s)-2,6-dimethyl-4-nitroso-piperazin-1-yl]-phenyl-methanone
Molecular Mass 247.293 g·mol−1
Heat of Formation -70.7 ± 16.7 kJ·mol−1
Dipole Moment 3.18 ± 1.08 D
Volume 303.81 Å 3
Surface Area 263.57 Å 2
HOMO Energy -9.52 ± 0.55 eV
LUMO Energy -0.36 ± eV
Point Group Symmetry C1
InChIKey FDCJUXDANKKYRM-QWRGUYRKSA-N
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