Geometry & MOs

Info

ID:	256261
PubChem CID:	103138046
Reduced:	O2N3C11H19 (1)
Stoich.:	A2B3C11D19 (1)
Weight, g/mol:	255.173548
ΔH_f, kcal/mol:	-62.69
Dipole, Da:	4.99
IP(EA), eV:	-9.97(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-(2,3-dimethylpiperidin-1-yl)isoquinolin-5-amine

Drug info:

PubChemData

Smile

CCC(C1=CN(N=N1)CC2CCC(O2)C)O

DOS

IR

Vibrations