Geometry & MOs

Info

ID:	259525
PubChem CID:	103167349
Reduced:	NO3C12H15 (1)
Stoich.:	AB3C12D15 (1)
Weight, g/mol:	254.13789
ΔH_f, kcal/mol:	-79.11
Dipole, Da:	5.28
IP(EA), eV:	-10.07(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-[(3-ethoxycyclobutyl)methyl]tetrazol-1-yl]propanoic acid

Drug info:

PubChemData

Smile

C1CC(C1)CC2=NC(=C(O2)C(=O)O)C3CC3

DOS

IR

Vibrations