Geometry & MOs

Info

ID:	296483
PubChem CID:	117577847
Reduced:	ON5C13H23 (1)
Stoich.:	AB5C13D23 (1)
Weight, g/mol:	249.195346
ΔH_f, kcal/mol:	-21.36
Dipole, Da:	4.81
IP(EA), eV:	-8.78(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(2-methyl-6-piperidin-1-ylpyrimidin-4-yl)propane-1,2-diamine

Drug info:

PubChemData

Smile

CC(C)NC1=CC(=NC=N1)N(C)CC2CNCCO2

DOS

IR

Vibrations