Geometry & MOs

Info

ID:	140140
PubChem CID:	52653654
Reduced:	BrFO3N4H16C20 (1)
Stoich.:	ABC3D4E16F20 (1)
Weight, g/mol:	370.115127
ΔH_f, kcal/mol:	-43.65
Dipole, Da:	8.88
IP(EA), eV:	-9.12(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(4-fluorophenyl)-1,3-thiazol-4-yl]-N-(4-propan-2-yloxyphenyl)acetamide

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)NC2=C(C=C(C=C2)F)Br)C3=C(N=C(O3)C4=CC=CO4)C#N

DOS

IR

Vibrations