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State	Conformation	minimum conformation	conformer description	state description
1	1	yes	C2V	¹A₁
2	1	yes	C2V	³B₁

	hartrees
Energy at 0K	-488.647778
Energy at 298.15K
HF Energy	-488.002715
Nuclear repulsion energy	100.056299

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A₁	848	823
2	A₁	337	327
3	B₂	860	834

Atom	y (Å)	z (Å)
Si1	0.000	0.581
F2	1.237	-0.452
F3	-1.237	-0.452

	Si1	F2	F3
Si1		1.6119	1.6119
F2	1.6119		2.4737
F3	1.6119	2.4737

All results from a given calculation for SiF₂ (Silicon difluoride)

using model chemistry: CCSD(T)/aug-cc-pVTZ

States and conformations

State 1 (¹A₁)

State 2 (³B₁)

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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You are here: Calculated > Energy > Optimized > Energy

	hartrees
Energy at 0K	-488.531205
Energy at 298.15K	-488.411443
HF Energy	-487.921598
Nuclear repulsion energy	98.886854

All results from a given calculation for SiF2 (Silicon difluoride)

using model chemistry: CCSD(T)/aug-cc-pVTZ

States and conformations

State 1 (1A1)

State 2 (3B1)

All results from a given calculation for SiF₂ (Silicon difluoride)

State 1 (¹A₁)

State 2 (³B₁)