Geometry & MOs

Info

ID:	176377
PubChem CID:	76039584
Reduced:	NOSiC16H23 (1)
Stoich.:	ABCD16E23 (1)
Weight, g/mol:	275.170541
ΔH_f, kcal/mol:	-10.13
Dipole, Da:	6.17
IP(EA), eV:	-10.03(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-dimethyl-2-oxo-6-(4-trimethylsilylbut-3-ynyl)cyclohexane-1-carbonitrile

Drug info:

PubChemData

Smile

CC1(C=CC(=O)C(C1CCC#C[Si](C)(C)C)C#N)C

DOS

IR

Vibrations