Formula |
C9H5NO3 |
IUPAC Name |
1-(4-nitrophenyl)prop-2-yn-1-one |
Molecular Mass |
175.141 g·mol−1 |
Heat of Formation |
206.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.21 ± 1.08 D |
Volume |
157.71 Å 3 |
Surface Area |
149.63 Å 2 |
HOMO Energy |
-10.96 ± 0.55 eV |
LUMO Energy |
1.07 ± eV |
Point Group Symmetry |
Cs
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Synonyms
|
- 1-(4'-nitrophenyl)prop-2-yn-1-one
- 2-propyn-1-one, 1-(4-nitrophenyl)-
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CAS Number(s) |
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InChIKey |
ADFALBPJQDKCFO-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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