Geometry & MOs

Info

ID:	256441
PubChem CID:	103139232
Reduced:	ON3C14H19 (1)
Stoich.:	AB3C14D19 (1)
Weight, g/mol:	303.021769
ΔH_f, kcal/mol:	-15.29
Dipole, Da:	4.63
IP(EA), eV:	-7.83(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,6-dichlorophenyl)-isoquinolin-8-ylmethanol

Drug info:

PubChemData

Smile

CCCC(CNC1=C2C=NC=CC2=C(C=C1)N)O

DOS

IR

Vibrations