Geometry & MOs

Info

ID:	73716
PubChem CID:	48420078
Reduced:	N2O3H18C23 (1)
Stoich.:	A2B3C18D23 (1)
Weight, g/mol:	356.116092
ΔH_f, kcal/mol:	-29.27
Dipole, Da:	10.06
IP(EA), eV:	-8.83(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

isoquinolin-7-yl 1-benzyl-2-oxopyridine-3-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CN2C=CC=C(C2=O)C(=O)OC3=CC4=C(C=C3)C=CN=C4

DOS

IR

Vibrations