Geometry & MOs

Info

ID:	8424
PubChem CID:	77643
Reduced:	OC5H7 (2)
Stoich.:	AB5C7 (2)
Weight, g/mol:	166.09938
ΔH_f, kcal/mol:	-86.78
Dipole, Da:	3.38
IP(EA), eV:	-8.66(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-tert-butylbenzene-1,2-diol

Drug info:

PubChemData

Smile

CC(C)(C)C1=C(C(=CC=C1)O)O

DOS

IR

Vibrations