Geometry & MOs

Info

ID:	129815
PubChem CID:	51073943
Reduced:	FNS2O3C15H16 (1)
Stoich.:	ABC2D3E15F16 (1)
Weight, g/mol:	289.142641
ΔH_f, kcal/mol:	-145.54
Dipole, Da:	6.69
IP(EA), eV:	-9.01(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-ethylpiperidine-1-carbonyl)-6-methyl-3H-furo[2,3-d]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC1=C(SC2=CC=CC(=C12)F)C(=O)N(C)C3CCS(=O)(=O)C3

DOS

IR

Vibrations