Geometry & MOs

Info

ID:	207979
PubChem CID:	80476649
Reduced:	SN2F3H9C11 (1)
Stoich.:	AB2C3D9E11 (1)
Weight, g/mol:	170.08777
ΔH_f, kcal/mol:	-95.92
Dipole, Da:	2.29
IP(EA), eV:	-9.82(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-(1,3-thiazol-5-yl)butan-1-amine

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(C2=CN=CS2)N)C(F)(F)F

DOS

IR

Vibrations