Geometry & MOs

Info

ID:	263546
PubChem CID:	103377543
Reduced:	NO2C9H21 (1)
Stoich.:	AB2C9D21 (1)
Weight, g/mol:	204.099774
ΔH_f, kcal/mol:	-120.37
Dipole, Da:	3.66
IP(EA), eV:	-9.37(1.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-hydroxyethoxy)-2-methyloxane-4-carboxylic acid

Drug info:

PubChemData

Smile

CCC(C)C(CN)OCCCO

DOS

IR

Vibrations