Geometry & MOs

Info

ID:	262060
PubChem CID:	103267659
Reduced:	NO4C14H21 (1)
Stoich.:	AB4C14D21 (1)
Weight, g/mol:	267.147058
ΔH_f, kcal/mol:	-163.89
Dipole, Da:	7.85
IP(EA), eV:	-9.51(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[(4-hydroxy-2-methylbutan-2-yl)amino]ethoxy]benzoic acid

Drug info:

PubChemData

Smile

CCC(CCNCCOC1=CC=CC(=C1)C(=O)O)O

DOS

IR

Vibrations