Geometry & MOs

Info

ID:	257085
PubChem CID:	103143663
Reduced:	N3C16H23 (1)
Stoich.:	A3B16C23 (1)
Weight, g/mol:	215.142248
ΔH_f, kcal/mol:	32.4
Dipole, Da:	3.45
IP(EA), eV:	-8.54(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-isoquinolin-8-yl-N',N'-dimethylethane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(CC)CCC(C1=CC=CC2=C1C=NC=C2)N

DOS

IR

Vibrations