Geometry & MOs

Info

ID:	288426
PubChem CID:	104316518
Reduced:	ClO4C11H13 (1)
Stoich.:	AB4C11D13 (1)
Weight, g/mol:	240.099774
ΔH_f, kcal/mol:	-174.39
Dipole, Da:	6.72
IP(EA), eV:	-9.88(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-hydroxybutoxy)-3-methoxybenzoic acid

Drug info:

PubChemData

Smile

CC(CCOC1=C(C=CC(=C1)Cl)C(=O)O)O

DOS

IR

Vibrations