Geometry & MOs

Info

ID:	184100
PubChem CID:	77108985
Reduced:	O2S2N5C10H15 (1)
Stoich.:	A2B2C5D10E15 (1)
Weight, g/mol:	273.12774
ΔH_f, kcal/mol:	11.88
Dipole, Da:	5.7
IP(EA), eV:	-9.2(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-6-methyl-2-(1-methyl-3,4-dihydro-2H-quinolin-6-yl)-5H-pyrimidin-4-one

Drug info:

PubChemData

Smile

CSC1(CCN(CC1)C(=O)C2=CN=NS2)C(=NO)N

DOS

IR

Vibrations