Geometry & MOs

Info

ID:	402082
PubChem CID:	135054209
Reduced:	OC8H9 (2)
Stoich.:	AB8C9 (2)
Weight, g/mol:	212.17763
ΔH_f, kcal/mol:	-38.33
Dipole, Da:	5.18
IP(EA), eV:	-9.74(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(S)-[(2S)-3-tert-butyloxiran-2-yl]-cyclohexylmethanol

Drug info:

PubChemData

Smile

CC/C=C/C\1COC/C1=C\C(=O)C2=CC=CC=C2

DOS

IR

Vibrations