Geometry & MOs

Info

ID:	264234
PubChem CID:	103444835
Reduced:	ClN4C15H21 (1)
Stoich.:	AB4C15D21 (1)
Weight, g/mol:	294.095748
ΔH_f, kcal/mol:	47.57
Dipole, Da:	2.54
IP(EA), eV:	-8.99(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chloropyridin-2-yl)-N-propyl-3-thiophen-3-ylpropan-1-amine

Drug info:

PubChemData

Smile

CCCNC(C1=CN(N=C1)CCC)C2=C(C=CC=N2)Cl

DOS

IR

Vibrations