Geometry & MOs

Info

ID:	257121
PubChem CID:	103143908
Reduced:	N2H16C17 (1)
Stoich.:	A2B16C17 (1)
Weight, g/mol:	234.115698
ΔH_f, kcal/mol:	64.27
Dipole, Da:	2.86
IP(EA), eV:	-9.19(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-isoquinolin-8-yl-3-methylaniline

Drug info:

PubChemData

Smile

CC(C1=CC=CC(=C1)C2=CC=CC3=C2C=NC=C3)N

DOS

IR

Vibrations