Geometry & MOs

Info

ID:	127858
PubChem CID:	51019629
Reduced:	O3C10H12 (1)
Stoich.:	A3B10C12 (1)
Weight, g/mol:	304.121178
ΔH_f, kcal/mol:	-103.67
Dipole, Da:	6.4
IP(EA), eV:	-10.43(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,2R,6R,7R)-4-(2-methylquinolin-4-yl)-4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione

Drug info:

PubChemData

Smile

CC(=O)[C@@H]1[C@H]2C[C@@H]([C@H]1C(=O)O)C=C2

DOS

IR

Vibrations