Formula |
C4H7NS |
IUPAC Name |
2-isothiocyanatopropane |
Molecular Mass |
101.170 g·mol−1 |
Heat of Formation |
69.3 ± 16.7 kJ·mol−1 |
Dipole Moment |
5.78 ± 1.08 D |
Volume |
135.74 Å 3 |
Surface Area |
148.83 Å 2 |
HOMO Energy |
-8.72 ± 0.55 eV |
LUMO Energy |
-0.07 ± eV |
Point Group Symmetry |
Cs
|
Synonyms
|
- bb_sc-1843
- isopropyl isothiocyanate
- propane, 2-isothiocyanato-
|
CAS Number(s) |
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InChIKey |
VHBFEIBMZHEWSX-UHFFFAOYSA-N |
QR Code |
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Links |
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|
Downloads |
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|
Elements |
H
S
C
N
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