2-(Propylsulfanyl)-6,7-Dihydroimidazo[1,2-A][1,3,5]Triazine-4(1H)-Thione

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Formula C8H12N4S2
IUPAC Name 4-propylsulfanyl-5,7-diaza-1-azonia-3-azanidabicyclo[4.3.0]nona-1(6),4-diene-2-thione
Molecular Mass 228.338 g·mol−1
Heat of Formation 230.9 ± 16.7 kJ·mol−1
Dipole Moment 3.14 ± 1.08 D
Volume 260.75 Å 3
Surface Area 250.01 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy -1.55 ± eV
Point Group Symmetry C1
InChIKey NVIQQSPALIUBLF-UHFFFAOYSA-N
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Elements H S C N