Geometry & MOs

Info

ID:	284324
PubChem CID:	104043335
Reduced:	N2C7H8 (2)
Stoich.:	A2B7C8 (2)
Weight, g/mol:	331.06841
ΔH_f, kcal/mol:	62.8
Dipole, Da:	2.51
IP(EA), eV:	-8.94(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(5-bromo-3-methylpyridin-2-yl)-3,4-dihydro-1H-isoquinolin-1-yl]methanamine

Drug info:

PubChemData

Smile

C1CN(C(C2=CC=CC=C21)CN)C3=NC=CC=N3

DOS

IR

Vibrations