Geometry & MOs

Info

ID:	404096
PubChem CID:	135064956
Reduced:	O2H12C13 (1)
Stoich.:	A2B12C13 (1)
Weight, g/mol:	192.11503
ΔH_f, kcal/mol:	-29.61
Dipole, Da:	3.67
IP(EA), eV:	-9.86(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(4-methylphenyl)oxiran-2-yl]propan-1-ol

Drug info:

PubChemData

Smile

C1CC(=O)[C@]2([C@@H]1C2)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations