Geometry & MOs

Info

ID:	256297
PubChem CID:	103138291
Reduced:	N3C16H21 (1)
Stoich.:	A3B16C21 (1)
Weight, g/mol:	255.173548
ΔH_f, kcal/mol:	32.56
Dipole, Da:	4.11
IP(EA), eV:	-8.23(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-N-(cyclopentylmethyl)-8-N-methylisoquinoline-5,8-diamine

Drug info:

PubChemData

Smile

CC1CCCN(CC1)C2=C3C=NC=CC3=C(C=C2)N

DOS

IR

Vibrations