1,3-Dichloro-6,7,8,9,10,12-Hexahydroazepino[2,1-B]Quinazoline

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Properties Simple | Detailed

Formula C13H14Cl2N2
IUPAC Name 1,3-dichloro-6,7,8,9,10,12-hexahydroazepino[2,1-b]quinazoline
Molecular Mass 269.170 g·mol−1
Heat of Formation 34.0 ± 16.7 kJ·mol−1
Dipole Moment 6.47 ± 1.08 D
Volume 297.88 Å 3
Surface Area 266.88 Å 2
HOMO Energy -8.53 ± 0.55 eV
LUMO Energy -0.85 ± eV
Point Group Symmetry C1
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InChIKey WTPSHLVHJOJDIF-UHFFFAOYSA-N
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Elements H C N Cl