Geometry & MOs

Info

ID:	295897
PubChem CID:	117546738
Reduced:	NOC17H25 (1)
Stoich.:	ABC17D25 (1)
Weight, g/mol:	226.110613
ΔH_f, kcal/mol:	-36.66
Dipole, Da:	2.43
IP(EA), eV:	-8.96(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C2(COC2)CC3CCCNC3)C

DOS

IR

Vibrations