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	hartrees
Energy at 0K	-113.947032
Energy at 298.15K	-113.948468
HF Energy	-113.947032
Nuclear repulsion energy	31.303742

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	2787	2755	66.41
2	A₁	1820	1798	109.82
3	A₁	1483	1465	7.30
4	B₁	1160	1147	4.72
5	B₂	2839	2806	147.67
6	B₂	1228	1214	6.43

Atom	y (Å)	z (Å)
O1	0.000	0.674
C2	0.000	-0.525
H3	0.950	-1.119
H4	-0.950	-1.119

	O1	C2	H3	H4
O1		1.1989	2.0294	2.0294
C2	1.1989		1.1207	1.1207
H3	2.0294	1.1207		1.9002
H4	2.0294	1.1207	1.9002

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	C2	H3	122.028		O1	C2	H4	122.028
H3	C2	H4	115.944

All results from a given calculation for H₂CO (Formaldehyde)

using model chemistry: LSDA/TZVP

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	-0.225
2	C	0.014
3	H	0.106
4	H	0.106

	x	y	z	Total
	0.000	0.000	-2.259	2.259
CHELPG
AIM
ESP

<r²>	17.091
(<r²>)^1/2	4.134

All results from a given calculation for H2CO (Formaldehyde)

using model chemistry: LSDA/TZVP

States and conformations

All results from a given calculation for H₂CO (Formaldehyde)