Geometry & MOs

Info

ID:	200269
PubChem CID:	79374899
Reduced:	O2F3N3C10H14 (1)
Stoich.:	A2B3C3D10E14 (1)
Weight, g/mol:	293.119798
ΔH_f, kcal/mol:	-232.53
Dipole, Da:	7.25
IP(EA), eV:	-9.68(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-6-methyl-3-[2-[(3-methylthiophen-2-yl)methylamino]ethyl]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC1=CC(=O)N(C(=N1)OC)CCNCC(F)(F)F

DOS

IR

Vibrations