Geometry & MOs

Info

ID:	256287
PubChem CID:	103138218
Reduced:	NOC13H27 (1)
Stoich.:	ABC13D27 (1)
Weight, g/mol:	282.184447
ΔH_f, kcal/mol:	-91.05
Dipole, Da:	0.98
IP(EA), eV:	-8.87(2.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(3-pyrrolidin-1-ylpyrrolidin-1-yl)isoquinolin-5-amine

Drug info:

PubChemData

Smile

CCCNCC(CC)CC1CCC(O1)C

DOS

IR

Vibrations