Geometry & MOs

Info

ID:	404010
PubChem CID:	135064370
Reduced:	BrINO3H9C10 (1)
Stoich.:	ABCD3E9F10 (1)
Weight, g/mol:	301.186421
ΔH_f, kcal/mol:	-22.85
Dipole, Da:	4.47
IP(EA), eV:	-9.51(-2.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-decyl-2-phenyl-1,3-thiazole

Drug info:

PubChemData

Smile

COC(=O)CN=C1C2=CC=CC=C2I(O1)Br

DOS

IR

Vibrations