Geometry & MOs

Info

ID:	56665
PubChem CID:	17505748
Reduced:	FSCl2O2N3H16C20 (1)
Stoich.:	ABC2D2E3F16G20 (1)
Weight, g/mol:	364.088164
ΔH_f, kcal/mol:	-70.82
Dipole, Da:	2.21
IP(EA), eV:	-9.3(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methyl]-3-methoxybenzamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C2=CC=C(C=C2)F)C(=O)N(C)CC(=O)NC3=C(C=CC=C3Cl)Cl

DOS

IR

Vibrations