Geometry & MOs

Info

ID:	399233
PubChem CID:	135038968
Reduced:	FNSO4H8C11 (1)
Stoich.:	ABCD4E8F11 (1)
Weight, g/mol:	250.077599
ΔH_f, kcal/mol:	-150.17
Dipole, Da:	8.78
IP(EA), eV:	-9.63(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethoxy-4-(1,3-thiazol-4-ylmethyl)aniline

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)S(=O)(=O)C2=CC(=C(C(=O)N2)F)O

DOS

IR

Vibrations