Geometry & MOs

Info

ID:	441797
PubChem CID:	135244867
Reduced:	ClNC9H10 (2)
Stoich.:	ABC9D10 (2)
Weight, g/mol:	497.094283
ΔH_f, kcal/mol:	14.25
Dipole, Da:	1.5
IP(EA), eV:	-8.29(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CN1CC(C2=C(C1)C(=CC(=C2)Cl)Cl)CCC3=CC=C(C=C3)N

DOS

IR

Vibrations