Geometry & MOs

Info

ID:	295841
PubChem CID:	117545521
Reduced:	FNOC12H16 (1)
Stoich.:	ABCD12E16 (1)
Weight, g/mol:	249.172879
ΔH_f, kcal/mol:	-54.86
Dipole, Da:	2.73
IP(EA), eV:	-9.16(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-[3-(4-propan-2-yloxyphenyl)oxetan-3-yl]ethanamine

Drug info:

PubChemData

Smile

CNCCC1(COC1)C2=CC(=CC=C2)F

DOS

IR

Vibrations