Geometry & MOs

Info

ID:	307093
PubChem CID:	125267555
Reduced:	FON4C16H19 (1)
Stoich.:	ABC4D16E19 (1)
Weight, g/mol:	230.116761
ΔH_f, kcal/mol:	-3.2
Dipole, Da:	4.15
IP(EA), eV:	-9.0(-1.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethyl-2-(pyridin-4-ylmethylamino)-5H-pyrimidin-4-one

Drug info:

PubChemData

Smile

CCN(CC)CCN1CN=C2C3=C(C=CC(=C3)F)N=C2C1=O

DOS

IR

Vibrations