Geometry & MOs

Info

ID:	257125
PubChem CID:	103143928
Reduced:	N4H10C13 (1)
Stoich.:	A4B10C13 (1)
Weight, g/mol:	267.045092
ΔH_f, kcal/mol:	103.91
Dipole, Da:	5.91
IP(EA), eV:	-8.99(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-2-isoquinolin-8-ylbenzaldehyde

Drug info:

PubChemData

Smile

C1=CC2=C(C=NC=C2)C(=C1)C3=NN=C(C=C3)N

DOS

IR

Vibrations