Geometry & MOs

Info

ID:	205429
PubChem CID:	80099253
Reduced:	NC18H31 (1)
Stoich.:	AB18C31 (1)
Weight, g/mol:	269.161349
ΔH_f, kcal/mol:	-28.97
Dipole, Da:	1.75
IP(EA), eV:	-8.7(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,3-diethyl-1-(4-fluorophenyl)sulfanylpentan-2-amine

Drug info:

PubChemData

Smile

CCC(CC)C(CC1=CC=CC=C1C)CNC(C)C

DOS

IR

Vibrations