1,2,3,4-Tetrahydropyrimidine-5-Carbonitrile

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Properties Simple | Detailed

Formula C5H7N3
IUPAC Name 1,2,3,4-tetrahydropyrimidine-5-carbonitrile
Molecular Mass 109.129 g·mol−1
Heat of Formation 219.9 ± 16.7 kJ·mol−1
Dipole Moment 5.60 ± 1.08 D
Volume 137.51 Å 3
Surface Area 146.39 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy -0.38 ± eV
Point Group Symmetry C1
InChIKey VILUEABPXFYGEJ-UHFFFAOYSA-N
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Elements H C N