Geometry & MOs

Info

ID:	324081
PubChem CID:	126676892
Reduced:	O2F3N4C21H23 (1)
Stoich.:	A2B3C4D21E23 (1)
Weight, g/mol:	244.98738
ΔH_f, kcal/mol:	-125.69
Dipole, Da:	4.54
IP(EA), eV:	-8.6(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-bromoprop-1-en-2-yl)-2-ethyl-4-methyl-1,3-thiazole

Drug info:

PubChemData

Smile

CCN(CC1=CC=C(C=C1)C(=C)O)C2=NN(C=N2)/C(=C/C=C(\C)/OC(F)(F)F)/C=C

DOS

IR

Vibrations