Geometry & MOs

Info

ID:	256489
PubChem CID:	103139577
Reduced:	ON2C15H18 (1)
Stoich.:	AB2C15D18 (1)
Weight, g/mol:	250.110613
ΔH_f, kcal/mol:	-10.48
Dipole, Da:	3.75
IP(EA), eV:	-8.03(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-phenylmethoxyisoquinolin-5-amine

Drug info:

PubChemData

Smile

C1CCC(CC1)OC2=C3C=NC=CC3=C(C=C2)N

DOS

IR

Vibrations