Geometry & MOs

Info

ID:	160232
PubChem CID:	57309578
Reduced:	N3O4C37H45 (1)
Stoich.:	A3B4C37D45 (1)
Weight, g/mol:	273.184112
ΔH_f, kcal/mol:	-107.68
Dipole, Da:	4.26
IP(EA), eV:	-8.43(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(6-methoxy-5-methylquinolin-8-yl)pentane-1,5-diamine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)OCC2=CC=CC=C2)CCC3CC(=O)CC4(C3CC[C@@]4(C(=O)CN5CCN(CC5)C6=CC=CC=N6)O)C

DOS

IR

Vibrations