Geometry & MOs

Info

ID:	323654
PubChem CID:	126675661
Reduced:	ON7C19H23 (1)
Stoich.:	AB7C19D23 (1)
Weight, g/mol:	189.078979
ΔH_f, kcal/mol:	91.91
Dipole, Da:	5.08
IP(EA), eV:	-8.19(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-methoxyisoquinolin-7-yl)methanol

Drug info:

PubChemData

Smile

C1CC1OC2=CC=CC(=C2)CN3C=C(C=N3)CC4=CC(=NC(=C4N)NN)N

DOS

IR

Vibrations