Geometry & MOs

Info

ID:	198762
PubChem CID:	79146319
Reduced:	SF2N2H10C14 (1)
Stoich.:	AB2C2D10E14 (1)
Weight, g/mol:	275.05509
ΔH_f, kcal/mol:	-31.49
Dipole, Da:	2.81
IP(EA), eV:	-8.84(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[2-(1,3-thiazol-2-yl)ethyl]-1,3-benzothiazol-2-amine

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)SC(=N2)NC3=CC(=CC(=C3)F)F

DOS

IR

Vibrations