Geometry & MOs

Info

ID:	58655
PubChem CID:	24712405
Reduced:	FO2N3C17H20 (1)
Stoich.:	AB2C3D17E20 (1)
Weight, g/mol:	326.090055
ΔH_f, kcal/mol:	-55.26
Dipole, Da:	4.93
IP(EA), eV:	-9.5(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butan-2-yl-2-[(2,4-difluorophenoxy)methyl]-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CCNC(=O)C1=COC(=N1)CN(CC2=CC=C(C=C2)F)C3CC3

DOS

IR

Vibrations