Geometry & MOs

Info

ID:	258278
PubChem CID:	103152505
Reduced:	ClNO4C14H18 (1)
Stoich.:	ABC4D14E18 (1)
Weight, g/mol:	243.096754
ΔH_f, kcal/mol:	-179.08
Dipole, Da:	8.1
IP(EA), eV:	-9.74(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methoxy-4-[[2-(tetrazol-1-yl)acetyl]amino]butanoic acid

Drug info:

PubChemData

Smile

COC(CC(=O)O)CNC(=O)CCC1=CC=CC=C1Cl

DOS

IR

Vibrations