Geometry & MOs

Info

ID:	210208
PubChem CID:	80774619
Reduced:	O2N4C15H24 (1)
Stoich.:	A2B4C15D24 (1)
Weight, g/mol:	248.200097
ΔH_f, kcal/mol:	6.02
Dipole, Da:	8.55
IP(EA), eV:	-8.23(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-ethylpiperidin-1-yl)-5-propan-2-ylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCNC1=CC(=CC(=C1)[N+](=O)[O-])N2CCC(CC2)N(C)C

DOS

IR

Vibrations