Geometry & MOs

Info

ID:	39541
PubChem CID:	8141271
Reduced:	FSN3O3H14C18 (1)
Stoich.:	ABC3D3E14F18 (1)
Weight, g/mol:	369.094726
ΔH_f, kcal/mol:	-23.59
Dipole, Da:	5.17
IP(EA), eV:	-9.11(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(N=C(S1)NC(=O)CC2=CC=CC=C2[N+](=O)[O-])C3=CC=C(C=C3)F

DOS

IR

Vibrations