Geometry & MOs

Info

ID:	295898
PubChem CID:	117546780
Reduced:	ON2C14H14 (1)
Stoich.:	AB2C14D14 (1)
Weight, g/mol:	226.110613
ΔH_f, kcal/mol:	31.65
Dipole, Da:	4.81
IP(EA), eV:	-8.72(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-pyridin-4-yloxetan-3-yl)aniline

Drug info:

PubChemData

Smile

C1C(CO1)(C2=CC(=CC=C2)N)C3=CN=CC=C3

DOS

IR

Vibrations