N-[(Z)-2H-Pyrrol-2-Ylidenemethyl]-2-Pyrimidinamine

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Properties Simple | Detailed

Formula C9H8N4
IUPAC Name n-[(e)-pyrrol-2-ylidenemethyl]pyrimidin-2-amine
Molecular Mass 172.187 g·mol−1
Heat of Formation 435.5 ± 16.7 kJ·mol−1
Dipole Moment 4.34 ± 1.08 D
Volume 204.72 Å 3
Surface Area 207.82 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy 0.60 ± eV
Point Group Symmetry Cs
InChIKey ATHJFIDJKVLFIF-BQYQJAHWSA-N
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Elements H C N