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	hartrees
Energy at 0K	-255.820582
Energy at 298.15K	-255.825958
HF Energy	-255.250372
Nuclear repulsion energy	159.154317

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A'	3592	3417	118.51
2	A'	3337	3175	1.39
3	A'	1413	1344	53.57
4	A'	1373	1306	7.06
5	A'	1196	1138	17.22
6	A'	1123	1069	6.42
7	A'	987	939	3.36
8	A'	977	930	1.50
9	A'	910	866	11.06
10	A'	811	772	2.68
11	A'	738	702	18.07
12	A"	885	842	24.29
13	A"	682	649	69.33
14	A"	669	636	3.52
15	A"	614	584	78.95

Atom	x (Å)	y (Å)
C1	1.088	0.265
N2	0.000	1.099
N3	-1.192	0.317
N4	-0.751	-1.004
N5	0.718	-1.028
H6	2.106	0.613
H7	-0.058	2.112

	C1	N2	N3	N4	N5	H6	H7
C1		1.3708	2.2808	2.2341	1.3445	1.0757	2.1732
N2	1.3708		1.4257	2.2330	2.2445	2.1609	1.0144
N3	2.2808	1.4257		1.3931	2.3362	3.3112	2.1231
N4	2.2341	2.2330	1.3931		1.4689	3.2825	3.1919
N5	1.3445	2.2445	2.3362	1.4689		2.1490	3.2337
H6	1.0757	2.1609	3.3112	3.2825	2.1490		2.6316
H7	2.1732	1.0144	2.1231	3.1919	3.2337	2.6316

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	N2	N3	109.279	C1	N2	H7	130.734
C1	N5	N4	105.054	N2	C1	N5	111.499
N2	C1	H6	123.631	N2	N3	N4	104.771
N3	N2	H7	119.987	N3	N4	N5	109.398
N5	C1	H6	124.870

All results from a given calculation for CH₂N₄ (1H-Tetrazole)

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 CH2N4 (1H-Tetrazole)

using model chemistry: MP2/3-21G*

States and conformations

All results from a given calculation for CH₂N₄ (1H-Tetrazole)