Geometry & MOs

Info

ID:	267027
PubChem CID:	103580488
Reduced:	SF3N3C9H14 (1)
Stoich.:	AB3C3D9E14 (1)
Weight, g/mol:	221.062283
ΔH_f, kcal/mol:	-144.05
Dipole, Da:	5.45
IP(EA), eV:	-9.07(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(oxolan-2-ylmethylsulfanyl)pyrazine-2-carbonitrile

Drug info:

PubChemData

Smile

CC1=NN=C(S1)NC(C)CCCC(F)(F)F

DOS

IR

Vibrations