Geometry & MOs

Info

ID:	404978
PubChem CID:	135071987
Reduced:	SiO4C18H30 (1)
Stoich.:	AB4C18D30 (1)
Weight, g/mol:	349.171165
ΔH_f, kcal/mol:	-194.66
Dipole, Da:	4.04
IP(EA), eV:	-8.82(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylphenyl)sulfonyl-2-[1-(2-methylprop-2-enyl)cyclohexyl]acetamide

Drug info:

PubChemData

Smile

CC#CC[C@H]([C@]1(C(=O)OCC1(C)C=C)O)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations