Geometry & MOs

Info

ID:	13027
PubChem CID:	220044
Reduced:	O2C13H20 (1)
Stoich.:	A2B13C20 (1)
Weight, g/mol:	208.14633
ΔH_f, kcal/mol:	-92.91
Dipole, Da:	1.51
IP(EA), eV:	-8.84(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-butan-2-ylphenoxy)propan-2-ol

Drug info:

PubChemData

Smile

CCC(C)C1=CC=CC=C1OCC(C)O

DOS

IR

Vibrations