Geometry & MOs

Info

ID:	288005
PubChem CID:	104306904
Reduced:	ClN3C17H24 (1)
Stoich.:	AB3C17D24 (1)
Weight, g/mol:	314.014432
ΔH_f, kcal/mol:	19.82
Dipole, Da:	4.68
IP(EA), eV:	-8.19(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dichloro-N-[3-(3-chloropropyl)phenyl]pyridin-2-amine

Drug info:

PubChemData

Smile

CCC(C)N1C=CC(=N1)CNC2=CC=CC(=C2)CCCCl

DOS

IR

Vibrations