Geometry & MOs

Info

ID:	217073
PubChem CID:	85087203
Reduced:	NSiO3C17H35 (1)
Stoich.:	ABC3D17E35 (1)
Weight, g/mol:	329.012267
ΔH_f, kcal/mol:	-223.76
Dipole, Da:	3.94
IP(EA), eV:	-8.79(1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-chloro-2-(4-chlorophenyl)-3aH-pyrazolo[4,3-c]quinolin-3-one

Drug info:

PubChemData

Smile

CC(C)[Si](C(C)C)(C(C)C)OC1CCN2C1C(C(CC2)O)O

DOS

IR

Vibrations