Geometry & MOs

Info

ID:	132258
PubChem CID:	51330619
Reduced:	FO3N5H14C15 (1)
Stoich.:	AB3C5D14E15 (1)
Weight, g/mol:	344.099477
ΔH_f, kcal/mol:	17.09
Dipole, Da:	5.77
IP(EA), eV:	-9.81(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-benzoyl-N-(2-fluoro-4-methylphenyl)-1,3-thiazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C2=NOC(=N2)CN3C(=C(C(=N3)C)[N+](=O)[O-])C)F

DOS

IR

Vibrations