Geometry & MOs

Info

ID:	256341
PubChem CID:	103138640
Reduced:	N4C17H22 (1)
Stoich.:	A4B17C22 (1)
Weight, g/mol:	241.157898
ΔH_f, kcal/mol:	54.28
Dipole, Da:	2.28
IP(EA), eV:	-7.54(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(3,4-dimethylpyrrolidin-1-yl)isoquinolin-5-amine

Drug info:

PubChemData

Smile

CN1C2CCC1CN(CC2)C3=C4C=NC=CC4=C(C=C3)N

DOS

IR

Vibrations