Geometry & MOs

Info

ID:	27285
PubChem CID:	820238
Reduced:	ClN3C12H12 (1)
Stoich.:	AB3C12D12 (1)
Weight, g/mol:	225.011205
ΔH_f, kcal/mol:	43.34
Dipole, Da:	2.07
IP(EA), eV:	-9.15(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-3-(chloromethyl)-7-methylquinoline

Drug info:

PubChemData

Smile

CC1=C(C(=NC(=N1)N)Cl)CC2=CC=CC=C2

DOS

IR

Vibrations