Geometry & MOs

Info

ID:	205543
PubChem CID:	80119147
Reduced:	ON2F3C10H17 (1)
Stoich.:	AB2C3D10E17 (1)
Weight, g/mol:	227.071306
ΔH_f, kcal/mol:	-192.46
Dipole, Da:	3.34
IP(EA), eV:	-9.36(1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-chloro-4-methoxyphenyl)methyl]oxetan-3-amine

Drug info:

PubChemData

Smile

C1CN(CCC1NC2COC2)CC(F)(F)F

DOS

IR

Vibrations