Formula |
C15H17N5S |
IUPAC Name |
5-(4-methylpiperazin-1-yl)imidazo[2,1-b][1,3,5]benzothiadiazepine |
Molecular Mass |
299.394 g·mol−1 |
Heat of Formation |
416.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.03 ± 1.08 D |
Volume |
350.77 Å 3 |
Surface Area |
306.5 Å 2 |
HOMO Energy |
-8.63 ± 0.55 eV |
LUMO Energy |
-0.78 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- pdsp1_001664
- pdsp2_001648
|
InChIKey |
FACMWMBWGSPRKO-UHFFFAOYSA-N |
QR Code |
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Links |
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|
DOI |
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Downloads |
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|
Elements |
H
S
C
N
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