Geometry & MOs

Info

ID:	256435
PubChem CID:	103139219
Reduced:	NOCl2H11C16 (1)
Stoich.:	ABC2D11E16 (1)
Weight, g/mol:	213.115364
ΔH_f, kcal/mol:	10.72
Dipole, Da:	3.38
IP(EA), eV:	-9.5(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

isoquinolin-8-yl-(2-methylcyclopropyl)methanol

Drug info:

PubChemData

Smile

C1=CC2=C(C=NC=C2)C(=C1)C(C3=CC(=CC(=C3)Cl)Cl)O

DOS

IR

Vibrations