Geometry & MOs

Info

ID:	87036
PubChem CID:	49890830
Reduced:	FSN2O3H23C25 (1)
Stoich.:	ABC2D3E23F25 (1)
Weight, g/mol:	410.110042
ΔH_f, kcal/mol:	-92.61
Dipole, Da:	3.45
IP(EA), eV:	-8.66(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5Z)-3-[(2-fluorophenyl)methyl]-5-[[1-(furan-2-ylmethyl)-2,5-dimethylpyrrol-3-yl]methylidene]-1,3-thiazolidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=CC(=C(N1CCOC2=CC=CC=C2)C)/C=C\3/C(=O)N(C(=O)S3)CC4=CC=CC=C4F

DOS

IR

Vibrations