Formula |
C15H9N3O |
IUPAC Name |
4-(4-oxo-1h-quinazolin-2-yl)benzonitrile |
Molecular Mass |
247.251 g·mol−1 |
Heat of Formation |
239.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.45 ± 1.08 D |
Volume |
283.34 Å 3 |
Surface Area |
268.94 Å 2 |
HOMO Energy |
-9.38 ± 0.55 eV |
LUMO Energy |
1.26 ± eV |
Point Group Symmetry |
Cs
|
Synonyms
|
- 4-(4-keto-1h-quinazolin-2-yl)benzonitrile
- oprea1_032242
|
InChIKey |
KINPFEIFSJMYNL-UHFFFAOYSA-N |
QR Code |
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Links |
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Downloads |
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|
Elements |
H
C
O
N
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