Geometry & MOs

Info

ID:	190900
PubChem CID:	78072951
Reduced:	O3N5C22H33 (1)
Stoich.:	A3B5C22D33 (1)
Weight, g/mol:	500.149429
ΔH_f, kcal/mol:	-110.97
Dipole, Da:	1.55
IP(EA), eV:	-8.67(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-aminopiperidin-1-yl)-3-[(2-chlorophenyl)methyl]-5-methyl-4-oxoimidazo[4,5-c]quinoline-7-carboxamide;hydrochloride

Drug info:

PubChemData

Smile

CC1C(C(C(O1)N2C=NC3=C(N=C(N=C32)OC4CCCC4)N)O)CC5CCCCC5

DOS

IR

Vibrations