Geometry & MOs

Info

ID:	38418
PubChem CID:	8036337
Reduced:	FOSN2H15C17 (1)
Stoich.:	ABCD2E15F17 (1)
Weight, g/mol:	372.02958
ΔH_f, kcal/mol:	-4.25
Dipole, Da:	5.49
IP(EA), eV:	-8.44(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenyl)-4-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-1,3-thiazole

Drug info:

PubChemData

Smile

COC1=CC=CC=C1CNC2=NC(=CS2)C3=CC=C(C=C3)F

DOS

IR

Vibrations