Geometry & MOs

Info

ID:	206185
PubChem CID:	80217985
Reduced:	BrNOC17H28 (1)
Stoich.:	ABCD17E28 (1)
Weight, g/mol:	264.200177
ΔH_f, kcal/mol:	-47.99
Dipole, Da:	2.62
IP(EA), eV:	-8.94(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-fluoro-4-methylphenyl)-N-methyl-3-(2-methylpyrrolidin-1-yl)propan-1-amine

Drug info:

PubChemData

Smile

CCCCC1CCC(CC1)C(C2=CC=C(O2)Br)NCC

DOS

IR

Vibrations