2-(4-Chloro-3-Ethoxy-1-Oxo-1H-Isochromen-7-Yl)Guanidine

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Properties Simple | Detailed

Formula C12H13ClN3O3+
IUPAC Name 2-(4-chloro-3-ethoxy-1-oxo-1h-isochromen-7-yl)guanidine
Molecular Mass 282.703 g·mol−1
Heat of Formation -338.4 ± 16.7 kJ·mol−1
Dipole Moment 2.82 ± 1.08 D
Volume 300.93 Å 3
Surface Area 286.49 Å 2
HOMO Energy -8.36 ± 0.55 eV
LUMO Energy 2.19 ± eV
Point Group Symmetry C1
InChIKey YFGMFEAGVQMIFH-UHFFFAOYSA-O
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Elements H C N O Cl