Geometry & MOs

Info

ID:	256466
PubChem CID:	103139403
Reduced:	ON4C9H16 (1)
Stoich.:	AB4C9D16 (1)
Weight, g/mol:	278.141913
ΔH_f, kcal/mol:	-9.2
Dipole, Da:	3.03
IP(EA), eV:	-9.79(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(dimethylamino)phenyl]-isoquinolin-8-ylmethanol

Drug info:

PubChemData

Smile

CC1CCC(O1)CN2C(=NC=N2)CN

DOS

IR

Vibrations