Geometry & MOs

Info

ID:	385851
PubChem CID:	134980147
Reduced:	O7C14H22 (1)
Stoich.:	A7B14C22 (1)
Weight, g/mol:	288.190942
ΔH_f, kcal/mol:	-304.24
Dipole, Da:	2.34
IP(EA), eV:	-10.01(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(1S,4S)-4-phenyl-6-trimethylsilylcyclohex-2-en-1-yl]propan-1-ol

Drug info:

PubChemData

Smile

C[C@@]1(CCC=C[C@H]1O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C=O

DOS

IR

Vibrations