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	hartrees
Energy at 0K	-113.869743
Energy at 298.15K	-113.871208
HF Energy	-113.869743
Nuclear repulsion energy	31.783615

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	3122	2818	48.86	138.05	0.18	0.30
2	A₁	2024	1827	146.99	8.41	0.34	0.51
3	A₁	1668	1506	10.01	12.36	0.59	0.74
4	B₁	1335	1205	0.62	0.68	0.75	0.86
5	B₂	3197	2886	132.50	58.65	0.75	0.86
6	B₂	1377	1243	22.91	4.24	0.75	0.86

Atom	y (Å)	z (Å)
O1	0.000	0.665
C2	0.000	-0.520
H3	0.926	-1.101
H4	-0.926	-1.101

	O1	C2	H3	H4
O1		1.1846	1.9938	1.9938
C2	1.1846		1.0932	1.0932
H3	1.9938	1.0932		1.8517
H4	1.9938	1.0932	1.8517

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	C2	H3	122.120		O1	C2	H4	122.120
H3	C2	H4	115.760

All results from a given calculation for H₂CO (Formaldehyde)

using model chemistry: HF/6-31G**

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	-0.432
2	C	0.245
3	H	0.093
4	H	0.093

	x	y	z	Total
	0.000	0.000	-2.664	2.664
CHELPG
AIM
ESP

<r²>	16.548
(<r²>)^1/2	4.068

All results from a given calculation for H2CO (Formaldehyde)

using model chemistry: HF/6-31G**

States and conformations

All results from a given calculation for H₂CO (Formaldehyde)