Geometry & MOs

Info

ID:	256422
PubChem CID:	103139170
Reduced:	N3C15H19 (1)
Stoich.:	A3B15C19 (1)
Weight, g/mol:	225.126598
ΔH_f, kcal/mol:	52.54
Dipole, Da:	4.04
IP(EA), eV:	-7.88(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-N-cyclopent-3-en-1-ylisoquinoline-5,8-diamine

Drug info:

PubChemData

Smile

CC(CNC1=C2C=NC=CC2=C(C=C1)N)C3CC3

DOS

IR

Vibrations