Geometry & MOs

Info

ID:	262059
PubChem CID:	103267653
Reduced:	NO4C11H17 (1)
Stoich.:	AB4C11D17 (1)
Weight, g/mol:	267.147058
ΔH_f, kcal/mol:	-157.56
Dipole, Da:	4.07
IP(EA), eV:	-9.19(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(3-hydroxypentylamino)ethoxy]benzoic acid

Drug info:

PubChemData

Smile

CCC(CCNCC1=C(OC=C1)C(=O)O)O

DOS

IR

Vibrations