Geometry & MOs

Info

ID:	256344
PubChem CID:	103138652
Reduced:	N2C8H11 (2)
Stoich.:	A2B8C11 (2)
Weight, g/mol:	284.200097
ΔH_f, kcal/mol:	45.74
Dipole, Da:	3.48
IP(EA), eV:	-8.2(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-N-[(1-ethylpyrrolidin-2-yl)methyl]-8-N-methylisoquinoline-5,8-diamine

Drug info:

PubChemData

Smile

CN1CCCC1CN(C)C2=C3C=NC=CC3=C(C=C2)N

DOS

IR

Vibrations