Geometry & MOs

Info

ID:	371332
PubChem CID:	127345719
Reduced:	O2S2N3C12H15 (1)
Stoich.:	A2B2C3D12E15 (1)
Weight, g/mol:	290.087827
ΔH_f, kcal/mol:	-30.25
Dipole, Da:	1.45
IP(EA), eV:	-9.19(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(oxolan-3-yl)-N-[2-oxo-5-(trifluoromethyl)-1H-pyridin-3-yl]acetamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)NC(=O)CC2CCOC2)SCC#N

DOS

IR

Vibrations