Geometry & MOs

Info

ID:	256131
PubChem CID:	103137259
Reduced:	ON3C15H19 (1)
Stoich.:	AB3C15D19 (1)
Weight, g/mol:	264.137497
ΔH_f, kcal/mol:	-5.19
Dipole, Da:	3.47
IP(EA), eV:	-7.71(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-isoquinolin-8-yl-N-methyl-1-(5-methylpyrazin-2-yl)methanamine

Drug info:

PubChemData

Smile

CC(C1CCCO1)NC2=C3C=NC=CC3=C(C=C2)N

DOS

IR

Vibrations