Geometry & MOs

Info

ID:	27088
PubChem CID:	814290
Reduced:	SN3O3C17H19 (1)
Stoich.:	AB3C3D17E19 (1)
Weight, g/mol:	333.094726
ΔH_f, kcal/mol:	-40.69
Dipole, Da:	2.85
IP(EA), eV:	-9.09(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopropylmethyl)-2-fluoro-N-[2-oxo-2-(1,3-thiazol-2-ylamino)ethyl]benzamide

Drug info:

PubChemData

Smile

C1CC1CN(CC(=O)NC2=NC=CS2)C(=O)COC3=CC=CC=C3

DOS

IR

Vibrations