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	hartrees
Energy at 0K	-1678.605778
Energy at 298.15K	-1678.608707
Nuclear repulsion energy	79.548114

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3051	2899	10.79
2	A₁	1338	1271	93.07
3	A₁	692	657	33.59
4	E	3134	2977	3.89
4	E	3134	2977	3.89
5	E	1482	1408	0.34
5	E	1482	1408	0.34
6	E	736	699	82.66
6	E	736	699	82.66

Atom	x (Å)	y (Å)	z (Å)
Cu1	0.000	0.000	0.458
C2	0.000	0.000	-1.346
H3	0.000	1.028	-1.739
H4	0.890	-0.514	-1.739
H5	-0.890	-0.514	-1.739

	Cu1	C2	H3	H4	H5
Cu1		1.8046	2.4258	2.4258	2.4258
C2	1.8046		1.1005	1.1005	1.1005
H3	2.4258	1.1005		1.7806	1.7806
H4	2.4258	1.1005	1.7806		1.7806
H5	2.4258	1.1005	1.7806	1.7806

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cu1	C2	H3	110.901	Cu1	C2	H4	110.901
Cu1	C2	H5	110.901	H3	C2	H4	108.004
H3	C2	H5	108.004	H4	C2	H5	108.004

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

using model chemistry: MP2=FULL/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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All results from a given calculation for CuCH3 (monomethyl copper)

using model chemistry: MP2=FULL/6-31G

States and conformations

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