Formula |
C12H13N3OS |
IUPAC Name |
1,5,6,7,8,9-hexahydro[1]benzothieno[2,3-d]imidazo[1,2-a]pyrimidin-2(3h)-one |
Molecular Mass |
247.316 g·mol−1 |
Heat of Formation |
21.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.66 ± 1.08 D |
Volume |
275.2 Å 3 |
Surface Area |
253.64 Å 2 |
HOMO Energy |
-8.15 ± 0.55 eV |
LUMO Energy |
-0.56 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 5,6,7,8,9,11-hexahydro[1]benzothieno[2,3-d]imidazo[1,2-a]pyrimidin-2(3h)-one
|
InChIKey |
YQZXTKDIHWCCEN-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
O
N
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