(16S)-17-Chloro-16-(4-Methylpiperazin-1-Yl)-Blahe

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Properties Simple | Detailed

Formula C17H20ClN3S
IUPAC Name (16s)-17-chloro-16-(4-methylpiperazin-1-yl)-blahe
Molecular Mass 333.879 g·mol−1
Heat of Formation 316.5 ± 16.7 kJ·mol−1
Dipole Moment 1.40 ± 1.08 D
Volume 386.09 Å 3
Surface Area 335.15 Å 2
HOMO Energy -8.46 ± 0.55 eV
LUMO Energy 2.15 ± eV
Point Group Symmetry C1
InChIKey WUJIHJKCRXRZHJ-CYBMUJFWSA-N
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Elements H S N C Cl