Geometry & MOs

Info

ID:	437244
PubChem CID:	135216890
Reduced:	INO6C16H34 (1)
Stoich.:	ABC6D16E34 (1)
Weight, g/mol:	420.216141
ΔH_f, kcal/mol:	-252.28
Dipole, Da:	1.86
IP(EA), eV:	-8.99(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(Z)-2-amino-4-oxopent-2-en-3-yl]-7-[2-(dimethylamino)ethoxy]-1-(pyridin-2-ylmethyl)quinolin-2-one

Drug info:

PubChemData

Smile

CCCCOCCOCCOCCOCCOCCOCCNI

DOS

IR

Vibrations