Geometry & MOs

Info

ID:	315418
PubChem CID:	126626210
Reduced:	SO3F5C18H21 (1)
Stoich.:	AB3C5D18E21 (1)
Weight, g/mol:	163.110947
ΔH_f, kcal/mol:	-362.59
Dipole, Da:	4.59
IP(EA), eV:	-8.77(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethyl-5,6,7,8-tetrahydropyrido[2,3-d]pyrimidine

Drug info:

PubChemData

Smile

C1CC(CCC1C2CCC(CO2)OS)C(OC3=CC(=C(C(=C3)F)F)F)(F)F

DOS

IR

Vibrations