Geometry & MOs

Info

ID:	343783
PubChem CID:	127266959
Reduced:	SN2O3C14H16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	312.130777
ΔH_f, kcal/mol:	-63.13
Dipole, Da:	1.43
IP(EA), eV:	-9.22(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[dimethyl(oxo)-lambda6-sulfanylidene]-1-[(4-fluoro-3-methylphenyl)methyl]pyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CSC=N1)C(C2=CC(=CC=C2)O)C(=O)OC

DOS

IR

Vibrations