(1R)-9-(3-Azetidinylamino)-1,8-Dimethyl-3,5-Dihydro[1,2,4]Triazino[3,4-C][1,4]Benzoxazin-2(1H)-One

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Formula C15H19N5O2
IUPAC Name (1r)-9-(azetidin-3-ylamino)-1,8-dimethyl-3,5-dihydro-1h-[1,2,4]triazino[3,4-c][1,4]benzoxazin-2-one
Molecular Mass 301.344 g·mol−1
Heat of Formation 0.5 ± 16.7 kJ·mol−1
Dipole Moment 3.50 ± 1.08 D
Volume 352.28 Å 3
Surface Area 307.38 Å 2
HOMO Energy -8.11 ± 0.55 eV
LUMO Energy -0.67 ± eV
Point Group Symmetry C1
InChIKey YWULJUISHNTGOC-SECBINFHSA-N
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