Geometry & MOs

Info

ID:	211347
PubChem CID:	80935543
Reduced:	ClON3C12H18 (1)
Stoich.:	ABC3D12E18 (1)
Weight, g/mol:	214.121846
ΔH_f, kcal/mol:	-25.99
Dipole, Da:	3.93
IP(EA), eV:	-9.02(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-6-(pyridin-2-ylmethyl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCC1=NC(=CC(=N1)Cl)N(C)CC2CCCO2

DOS

IR

Vibrations