Geometry & MOs

Info

ID:	407
PubChem CID:	2719
Reduced:	ClN3C18H26 (1)
Stoich.:	AB3C18D26 (1)
Weight, g/mol:	319.181526
ΔH_f, kcal/mol:	8.29
Dipole, Da:	6.18
IP(EA), eV:	-8.61(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(7-chloroquinolin-4-yl)-1-N,1-N-diethylpentane-1,4-diamine

Drug info:

PubChemData

Smile

CCN(CC)CCCC(C)NC1=C2C=CC(=CC2=NC=C1)Cl

DOS

IR

Vibrations