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	hartrees
Energy at 0K	-237.998551
Energy at 298.15K	-237.999824
HF Energy	-237.357625
Nuclear repulsion energy	70.361761

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)
1	A'	3190	3190
2	A'	1203	1203
3	A'	1057	1057
4	A'	558	558
5	A"	1375	1375
6	A"	1225	1225

Atom	x (Å)	y (Å)	z (Å)
C1	0.030	0.506	0.000
H2	-0.721	1.288	0.000
F3	0.030	-0.240	1.094
F4	0.030	-0.240	-1.094

	C1	H2	F3	F4
C1		1.0840	1.3247	1.3247
H2	1.0840		2.0242	2.0242
F3	1.3247	2.0242		2.1884
F4	1.3247	2.0242	2.1884

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
H2	C1	F3	113.986		H2	C1	F4	113.986
F3	C1	F4	111.380

All results from a given calculation for CHF₂ (difluoromethyl radical)

using model chemistry: ROMP2/cc-pVTZ

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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Calc. vs exp. Bad Vib. HF vs MP2 Bad scale factors Low excited states Oddities NaCN Is not linear FAQ Help Units Choose Units Energy Bond length Rotational Constant Moment of Inertia Dipole and Quadrupole Polarizability Explanations Hartree cm-1 Debye Credits Just show me Show me a calculated geometry Summary Using older interface Limit Basis sets Method options List Recent molecules Choose a few Molecules Number of atoms By heavy atoms Diatomics InChI Deuterated Dimers Geometry Point group Point group count Bonds types Isodesmic reactions Bad point group Multiple conformers, states Vibrations Big anharmonicity Energy Enthalpy at 0 Kelvin Similar molecules Similar Isomers Cis/trans Tautomers Multiple conformers, states Ions, Dipoles, etc. List Ions Ionization changes point group Dipole Quadrupole Polarizability Proton Affinities Index of CCCBDB Feedback Error form Wants
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Number	Element	Mulliken
1	C	0.371
2	H	0.081
3	F	-0.226
4	F	-0.226

<r²>	36.178
(<r²>)^1/2	6.015

All results from a given calculation for CHF2 (difluoromethyl radical)

using model chemistry: ROMP2/cc-pVTZ

States and conformations

All results from a given calculation for CHF₂ (difluoromethyl radical)