Geometry & MOs

Info

ID:	261280
PubChem CID:	103224911
Reduced:	NO4C10H19 (1)
Stoich.:	AB4C10D19 (1)
Weight, g/mol:	273.030708
ΔH_f, kcal/mol:	-188.91
Dipole, Da:	3.1
IP(EA), eV:	-9.62(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-2-(4-nitrophenyl)sulfinylpropanoic acid

Drug info:

PubChemData

Smile

CC1CCN(C1CO)C(COC)C(=O)O

DOS

IR

Vibrations