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 SiH₃CCl₃ ((trichloromethyl)silane)

using model chemistry: MP3=FULL/cc-pV(T+d)Z

States and conformations

Geometric Data calculated at MP3=FULL/cc-pV(T+d)Z

Point Group is C_3v

Cartesians (Å)

Atom	x (Å)	y (Å)	z (Å)
Si1	0.000	0.000	1.850
C2	0.000	0.000	-0.051
H3	0.000	-1.400	2.291
H4	1.212	0.700	2.291
H5	-1.212	0.700	2.291
Cl6	0.000	1.674	-0.637
Cl7	1.450	-0.837	-0.637
Cl8	-1.450	-0.837	-0.637

Atom - Atom Distances (Å)

	Si1	C2	H3	H4	H5	Cl6	Cl7	Cl8
Si1		1.9020	1.4672	1.4672	1.4672	2.9979	2.9979	2.9979
C2	1.9020		2.7286	2.7286	2.7286	1.7731	1.7731	1.7731
H3	1.4672	2.7286		2.4241	2.4241	4.2445	3.3149	3.3149
H4	1.4672	2.7286	2.4241		2.4241	3.3149	3.3149	4.2445
H5	1.4672	2.7286	2.4241	2.4241		3.3149	4.2445	3.3149
Cl6	2.9979	1.7731	4.2445	3.3149	3.3149		2.8990	2.8990
Cl7	2.9979	1.7731	3.3149	3.3149	4.2445	2.8990		2.8990
Cl8	2.9979	1.7731	3.3149	4.2445	3.3149	2.8990	2.8990

More geometry information
Calculated Bond Angles

atom1	atom2	atom3	angle		atom1	atom2	atom3	angle
Si1	C2	Cl6	109.271		Si1	C2	Cl7	109.271
Si1	C2	Cl8	109.271		C2	Si1	H3	107.468
C2	Si1	H4	107.468		C2	Si1	H5	107.468
H3	Si1	H4	111.398		H3	Si1	H5	111.398
H4	Si1	H5	111.398		Cl6	C2	Cl7	109.671
Cl6	C2	Cl8	109.671		Cl7	C2	Cl8	109.671