Formula |
C9H9NO |
IUPAC Name |
[(1r)-1-isocyanatoethyl]benzene |
Molecular Mass |
147.174 g·mol−1 |
Heat of Formation |
-19.8 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.39 ± 1.08 D |
Volume |
188.25 Å 3 |
Surface Area |
186.53 Å 2 |
HOMO Energy |
-9.97 ± 0.55 eV |
LUMO Energy |
-0.24 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- (r)-()-1-phenylethyl isocyanate
- (r)-()-alpha-methylbenzyl isocyanate
|
InChIKey |
JJSCUXAFAJEQGB-MRVPVSSYSA-N |
QR Code |
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Links |
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|
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Downloads |
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|
Elements |
H
C
O
N
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