Geometry & MOs

Info

ID:	256416
PubChem CID:	103139116
Reduced:	NOC17H23 (1)
Stoich.:	ABC17D23 (1)
Weight, g/mol:	266.105528
ΔH_f, kcal/mol:	-32.35
Dipole, Da:	3.64
IP(EA), eV:	-9.28(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

isoquinolin-8-yl-(3-methoxypyridin-4-yl)methanol

Drug info:

PubChemData

Smile

CCCCC(CC)C(C1=CC=CC2=C1C=NC=C2)O

DOS

IR

Vibrations