Geometry & MOs

Info

ID:	5255
PubChem CID:	12841
Reduced:	OC6H9 (2)
Stoich.:	AB6C9 (2)
Weight, g/mol:	194.13068
ΔH_f, kcal/mol:	-86.86
Dipole, Da:	2.19
IP(EA), eV:	-8.71(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-tert-butylphenoxy)ethanol

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)OCCO

DOS

IR

Vibrations