Essramycin

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Properties Simple | Detailed

Formula C14H12N4O2
IUPAC Name 5-methyl-2-phenacyl-1h-[1,2,4]triazolo[1,5-a]pyrimidin-7-one
Molecular Mass 268.271 g·mol−1
Heat of Formation 2446.9 ± 16.7 kJ·mol−1
Dipole Moment 2.77 ± 1.08 D
Volume 291.79 Å 3
Surface Area 260.7 Å 2
HOMO Energy -10.21 ± 0.55 eV
LUMO Energy -3.04 ± eV
Point Group Symmetry C1
InChIKey OFYCCAJFLXMBKD-UHFFFAOYSA-N
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