Geometry & MOs

Info

ID:	207098
PubChem CID:	80346080
Reduced:	SN2Cl3H13C15 (1)
Stoich.:	AB2C3D13E15 (1)
Weight, g/mol:	269.071975
ΔH_f, kcal/mol:	38.84
Dipole, Da:	4.29
IP(EA), eV:	-9.2(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-(quinolin-8-ylmethyl)pyridin-2-amine

Drug info:

PubChemData

Smile

C1=CSC=C1CCN2C3=CC(=C(C=C3N=C2CCCl)Cl)Cl

DOS

IR

Vibrations