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	hartrees
Energy at 0K	-1670.586379
Energy at 298.15K	-1670.589332
Nuclear repulsion energy	81.866929

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3074	2934	9.74
2	A₁	1408	1344	53.05
3	A₁	728	695	7.59
4	E	3136	2993	2.12
4	E	3136	2993	2.12
5	E	1492	1424	0.00
5	E	1492	1424	0.00
6	E	736	703	61.88
6	E	736	703	61.88

Atom	x (Å)	y (Å)	z (Å)
Cu1	0.000	0.000	0.444
C2	0.000	0.000	-1.297
H3	0.000	1.019	-1.701
H4	0.883	-0.510	-1.701
H5	-0.883	-0.510	-1.701

	Cu1	C2	H3	H4	H5
Cu1		1.7409	2.3746	2.3746	2.3746
C2	1.7409		1.0963	1.0963	1.0963
H3	2.3746	1.0963		1.7652	1.7652
H4	2.3746	1.0963	1.7652		1.7652
H5	2.3746	1.0963	1.7652	1.7652

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cu1	C2	H3	111.615	Cu1	C2	H4	111.615
Cu1	C2	H5	111.615	H3	C2	H4	107.245
H3	C2	H5	107.245	H4	C2	H5	107.245

All results from a given calculation for CuCH₃ (monomethyl copper)

using model chemistry: MP2/3-21G

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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All results from a given calculation for CuCH3 (monomethyl copper)

using model chemistry: MP2/3-21G

States and conformations

All results from a given calculation for CuCH₃ (monomethyl copper)