Geometry & MOs

Info

ID:	261254
PubChem CID:	103224346
Reduced:	SO4C7H14 (1)
Stoich.:	AB4C7D14 (1)
Weight, g/mol:	248.09094
ΔH_f, kcal/mol:	-189.18
Dipole, Da:	4.05
IP(EA), eV:	-9.57(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-2-(5-phenyltetrazol-2-yl)propanoic acid

Drug info:

PubChemData

Smile

CC(CO)SC(COC)C(=O)O

DOS

IR

Vibrations