Geometry & MOs

Info

ID:	206242
PubChem CID:	80222519
Reduced:	FNOC17H26 (1)
Stoich.:	ABCD17E26 (1)
Weight, g/mol:	250.062139
ΔH_f, kcal/mol:	-109.14
Dipole, Da:	4.04
IP(EA), eV:	-9.22(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-2-(5-chloropyridin-2-yl)-5-ethyl-1H-pyrimidin-4-one

Drug info:

PubChemData

Smile

CC1CCC(CC1)(CN)C(C)(C2=CC(=C(C=C2)C)F)O

DOS

IR

Vibrations