Geometry & MOs

Info

ID:	189558
PubChem CID:	77872721
Reduced:	NO5H9C11 (1)
Stoich.:	AB5C9D11 (1)
Weight, g/mol:	225.136493
ΔH_f, kcal/mol:	-130.79
Dipole, Da:	4.83
IP(EA), eV:	-9.4(-1.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(5-amino-2-hydroxy-4-methylpentoxy)phenol

Drug info:

PubChemData

Smile

COC1=CC2=NC=C(C(=O)C2C=C1)OC(=O)O

DOS

IR

Vibrations