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	hartrees
Energy at 0K	-1678.964269
Energy at 298.15K	-1678.967120
Nuclear repulsion energy	77.812920

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3121	2932	22.31
2	A₁	1189	1116	79.04
3	A₁	573	538	12.27
4	E	3240	3043	1.94
4	E	3240	3043	1.94
5	E	1490	1399	0.09
5	E	1490	1399	0.09
6	E	730	686	69.96
6	E	730	686	69.96

Atom	x (Å)	y (Å)	z (Å)
Cu1	0.000	0.000	0.470
C2	0.000	0.000	-1.396
H3	0.000	1.030	-1.748
H4	0.892	-0.515	-1.748
H5	-0.892	-0.515	-1.748

	Cu1	C2	H3	H4	H5
Cu1		1.8659	2.4455	2.4455	2.4455
C2	1.8659		1.0887	1.0887	1.0887
H3	2.4455	1.0887		1.7843	1.7843
H4	2.4455	1.0887	1.7843		1.7843
H5	2.4455	1.0887	1.7843	1.7843

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Cu1	C2	H3	108.868	Cu1	C2	H4	108.868
Cu1	C2	H5	108.868	H3	C2	H4	110.067
H3	C2	H5	110.067	H4	C2	H5	110.067

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

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

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/6-31+G**

States and conformations

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