Geometry & MOs

Info

ID:	193197
PubChem CID:	78355697
Reduced:	NO2C11H14 (2)
Stoich.:	AB2C11D14 (2)
Weight, g/mol:	299.163377
ΔH_f, kcal/mol:	-139.9
Dipole, Da:	8.38
IP(EA), eV:	-8.76(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(3,4-dihydro-1H-isoquinolin-2-yl)-3-methyl-1-prop-2-enyl-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C(C)C)C(=CC(=O)O2)COC(=O)C3C4CCCCC4NN3

DOS

IR

Vibrations