Geometry & MOs

Info

ID:	56659
PubChem CID:	17505072
Reduced:	NSO2C10H10 (2)
Stoich.:	ABC2D10E10 (2)
Weight, g/mol:	330.083827
ΔH_f, kcal/mol:	-91.8
Dipole, Da:	5.51
IP(EA), eV:	-9.21(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-fluoro-4-methyl-N-[[5-(2-methyl-1,3-thiazol-4-yl)furan-2-yl]methyl]benzamide

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C3=NC4=CC=CC=C4S3

DOS

IR

Vibrations