Geometry & MOs

Info

ID:	256140
PubChem CID:	103137308
Reduced:	NC5H7 (3)
Stoich.:	AB5C7 (3)
Weight, g/mol:	235.110947
ΔH_f, kcal/mol:	29.07
Dipole, Da:	4.15
IP(EA), eV:	-8.16(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

isoquinolin-8-yl(pyridin-3-yl)methanamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations