Geometry & MOs

Info

ID:	280768
PubChem CID:	103851190
Reduced:	N3C15H23 (1)
Stoich.:	A3B15C23 (1)
Weight, g/mol:	272.145555
ΔH_f, kcal/mol:	38.19
Dipole, Da:	4.89
IP(EA), eV:	-8.66(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-chloro-4-fluorophenyl)methyl]-N'-methyl-N'-propan-2-ylpropane-1,3-diamine

Drug info:

PubChemData

Smile

CC(C)N(C)CCCNCC1=CC=CC=C1C#N

DOS

IR

Vibrations