9-Methyl-4-Phenyl-6H-Thieno[3,2-F][1,2,4]Triazolo[4,3-A][1,4]Diazepine

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Formula C15H12N4S
IUPAC Name 9-methyl-4-phenyl-6h-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine
Molecular Mass 280.348 g·mol−1
Heat of Formation 527.9 ± 16.7 kJ·mol−1
Dipole Moment 7.79 ± 1.08 D
Volume 317.69 Å 3
Surface Area 282.09 Å 2
HOMO Energy -9.61 ± 0.55 eV
LUMO Energy 0.58 ± eV
Point Group Symmetry C1
InChIKey SIRFTOWPWPCSOP-UHFFFAOYSA-N
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Elements H C S N