Geometry & MOs

Info

ID:	441948
PubChem CID:	135246923
Reduced:	OF2N3C24H27 (1)
Stoich.:	AB2C3D24E27 (1)
Weight, g/mol:	221.105193
ΔH_f, kcal/mol:	-51.45
Dipole, Da:	3.42
IP(EA), eV:	-8.56(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[3-(oxiran-2-ylmethoxy)phenoxy]methyl]aziridine

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1C2=C(N=CC=C2)OC3=CCC=C(N=C3)C(CN(C)CC)(F)F

DOS

IR

Vibrations