Geometry & MOs

Info

ID:	45864
PubChem CID:	10518337
Reduced:	OC10H14 (2)
Stoich.:	AB10C14 (2)
Weight, g/mol:	300.175686
ΔH_f, kcal/mol:	-83.66
Dipole, Da:	3.4
IP(EA), eV:	-8.55(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(S)-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-[(1R)-2-trimethylsilyloxycyclohex-2-en-1-yl]methanol

Drug info:

PubChemData

Smile

CC(C)(C)O[C@@H]1[C@@H]2C[C@H](C=C1OC(C)(C)C)C3=CC=CC=C23

DOS

IR

Vibrations