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	hartrees
Energy at 0K	-114.481572
Energy at 298.15K	-114.483008
HF Energy	-114.481572
Nuclear repulsion energy	31.051515

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	2781	2765	64.56	148.99	0.16	0.28
2	A₁	1773	1764	85.19	2.95	0.31	0.47
3	A₁	1506	1497	7.04	14.43	0.63	0.77
4	B₁	1158	1151	1.55	2.18	0.75	0.86
5	B₂	2812	2796	173.92	82.13	0.75	0.86
6	B₂	1236	1230	11.42	6.80	0.75	0.86

Atom	y (Å)	z (Å)
O1	0.000	0.681
C2	0.000	-0.530
H3	0.944	-1.135
H4	-0.944	-1.135

	O1	C2	H3	H4
O1		1.2115	2.0464	2.0464
C2	1.2115		1.1205	1.1205
H3	2.0464	1.1205		1.8870
H4	2.0464	1.1205	1.8870

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
O1	C2	H3	122.644		O1	C2	H4	122.644
H3	C2	H4	114.713

All results from a given calculation for H₂CO (Formaldehyde)

using model chemistry: BLYP/6-31G(2df,p)

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	-0.132
2	C	-0.035
3	H	0.083
4	H	0.083

	x	y	z	Total
	0.000	0.000	-1.955	1.955
CHELPG
AIM
ESP

<r²>	17.033
(<r²>)^1/2	4.127

All results from a given calculation for H2CO (Formaldehyde)

using model chemistry: BLYP/6-31G(2df,p)

States and conformations

All results from a given calculation for H₂CO (Formaldehyde)