(2R)-2-Isothiocyanatopentane

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Properties Simple | Detailed

Formula C6H11NS
IUPAC Name (2r)-2-isothiocyanatopentane
Molecular Mass 129.223 g·mol−1
Heat of Formation 25.0 ± 16.7 kJ·mol−1
Dipole Moment 5.04 ± 1.08 D
Volume 172.19 Å 3
Surface Area 172.16 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy -0.60 ± eV
Point Group Symmetry C1
InChIKey SQBOSXLLKLBNSH-ZCFIWIBFSA-N
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Elements H C S N