Geometry & MOs

Info

ID:	271519
PubChem CID:	103682383
Reduced:	NSO3C11H23 (1)
Stoich.:	ABC3D11E23 (1)
Weight, g/mol:	287.168543
ΔH_f, kcal/mol:	-151.92
Dipole, Da:	4.71
IP(EA), eV:	-9.66(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluorophenyl)-N-[2-(2-methoxyphenyl)ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCCS(=O)(=O)NC1CC(C1(C)C)OCC

DOS

IR

Vibrations