Geometry & MOs

Info

ID:	256149
PubChem CID:	103137378
Reduced:	N2C19H24 (1)
Stoich.:	A2B19C24 (1)
Weight, g/mol:	264.126263
ΔH_f, kcal/mol:	49.06
Dipole, Da:	1.03
IP(EA), eV:	-9.03(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

isoquinolin-8-yl-(4-methoxyphenyl)methanamine

Drug info:

PubChemData

Smile

CCCNC(C1C2C1CCC2)C3=CC=CC4=C3C=NC=C4

DOS

IR

Vibrations