Geometry & MOs

Info

ID:	424138
PubChem CID:	135121462
Reduced:	O2N3C14H15 (1)
Stoich.:	A2B3C14D15 (1)
Weight, g/mol:	264.089878
ΔH_f, kcal/mol:	-12.46
Dipole, Da:	5.41
IP(EA), eV:	-9.07(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(methylamino)-3-phenylisoquinoline-5,8-dione

Drug info:

PubChemData

Smile

CC(=O)N1C2=CC=CC=C2N=C1/N=C/CCCC=O

DOS

IR

Vibrations