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	hartrees
Energy at 0K	-311.757090
Energy at 298.15K
HF Energy	-311.757090
Nuclear repulsion energy	122.397573

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)	Raman Act (Å⁴/u)	Dep P	Dep U
1	A₁	2148	1947	634.66	8.18	0.19	0.32
2	A₁	1096	993	60.42	5.27	0.07	0.13
3	A₁	644	584	6.39	0.70	0.74	0.85
4	B₁	890	806	65.41	1.01	0.75	0.86
5	B₂	1440	1305	481.76	0.32	0.75	0.86
6	B₂	692	627	14.51	1.71	0.75	0.86

Atom	y (Å)	z (Å)
O1	0.000	1.285
C2	0.000	0.134
F3	1.040	-0.616
F4	-1.040	-0.616

	O1	C2	F3	F4
O1		1.1504	2.1669	2.1669
C2	1.1504		1.2828	1.2828
F3	2.1669	1.2828		2.0808
F4	2.1669	1.2828	2.0808

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	C2	F3	125.800		O1	C2	F4	125.800
F3	C2	F4	108.400

All results from a given calculation for CF₂O (Carbonic difluoride)

using model chemistry: HF/Def2TZVPP

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	O	-0.334
2	C	0.737
3	F	-0.201
4	F	-0.201

	x	y	z	Total
	0.000	0.000	-1.311	1.311
CHELPG
AIM
ESP

<r²>	52.703
(<r²>)^1/2	7.260

All results from a given calculation for CF2O (Carbonic difluoride)

using model chemistry: HF/Def2TZVPP

States and conformations

All results from a given calculation for CF₂O (Carbonic difluoride)