Geometry & MOs

Info

ID:	50449
PubChem CID:	12012987
Reduced:	OC8H11 (2)
Stoich.:	AB8C11 (2)
Weight, g/mol:	198.16198
ΔH_f, kcal/mol:	-65.28
Dipole, Da:	2.27
IP(EA), eV:	-9.57(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2R,3S)-2,3-dimethyloxiran-2-yl]cyclooctan-1-ol

Drug info:

PubChemData

Smile

C[C@@H]1[C@](O1)(C2=CC=CC=C2)C3(CCCCCC3)O

DOS

IR

Vibrations