Geometry & MOs

Info

ID:	121274
PubChem CID:	50761462
Reduced:	FOSN3H16C18 (1)
Stoich.:	ABCD3E16F18 (1)
Weight, g/mol:	371.073991
ΔH_f, kcal/mol:	-16.43
Dipole, Da:	5.29
IP(EA), eV:	-8.54(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[[4-amino-5-(4-fluorobenzoyl)-1,3-thiazol-2-yl]amino]benzoate

Drug info:

PubChemData

Smile

CCC1=CC=CC=C1NC2=NC(=C(S2)C(=O)C3=CC=C(C=C3)F)N

DOS

IR

Vibrations