Geometry & MOs

Info

ID:	280093
PubChem CID:	103846793
Reduced:	ClN3C12H18 (1)
Stoich.:	AB3C12D18 (1)
Weight, g/mol:	251.168543
ΔH_f, kcal/mol:	13.53
Dipole, Da:	5.93
IP(EA), eV:	-8.61(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-fluoro-5-methylphenyl)methyl]-2,2-dimethyloxan-4-amine

Drug info:

PubChemData

Smile

CCN1CCN(CC1C)C2=CC(=NC=C2)Cl

DOS

IR

Vibrations