Geometry & MOs

Info

ID:	200675
PubChem CID:	79426354
Reduced:	O4C11H18 (1)
Stoich.:	A4B11C18 (1)
Weight, g/mol:	174.089209
ΔH_f, kcal/mol:	-189.22
Dipole, Da:	4.63
IP(EA), eV:	-9.77(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-hydroxyethyl)oxane-4-carboxylic acid

Drug info:

PubChemData

Smile

C1COCC1CC2(CCOCC2)C(=O)O

DOS

IR

Vibrations