Geometry & MOs

Info

ID:	279800
PubChem CID:	103845215
Reduced:	N3C14H23 (1)
Stoich.:	A3B14C23 (1)
Weight, g/mol:	252.162649
ΔH_f, kcal/mol:	29.53
Dipole, Da:	2.37
IP(EA), eV:	-8.99(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopenten-1-yl)-N-(isoquinolin-4-ylmethyl)ethanamine

Drug info:

PubChemData

Smile

CCCN1C=C(C=N1)CNCCC2=CCCC2

DOS

IR

Vibrations