Geometry & MOs

Info

ID:	259371
PubChem CID:	103164769
Reduced:	NO3C13H23 (1)
Stoich.:	AB3C13D23 (1)
Weight, g/mol:	273.147727
ΔH_f, kcal/mol:	-143.54
Dipole, Da:	5.15
IP(EA), eV:	-9.76(0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[5-[(3-ethoxycyclobutyl)methyl]-1,2,4-oxadiazol-3-yl]aniline

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(=O)NC2(CCC2)CO

DOS

IR

Vibrations