Geometry & MOs

Info

ID:	327197
PubChem CID:	126689191
Reduced:	BrN2O2C15H17 (1)
Stoich.:	AB2C2D15E17 (1)
Weight, g/mol:	459.263425
ΔH_f, kcal/mol:	-58.95
Dipole, Da:	6.53
IP(EA), eV:	-8.89(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-8-[6-(3-piperidin-1-ylpropoxy)pyridin-3-yl]-1-propan-2-ylimidazo[4,5-c]quinolin-2-one

Drug info:

PubChemData

Smile

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC(C)C)Br

DOS

IR

Vibrations