Geometry & MOs

Info

ID:	426585
PubChem CID:	135150851
Reduced:	OSBr2N4H16C17 (1)
Stoich.:	ABC2D4E16F17 (1)
Weight, g/mol:	465.91329
ΔH_f, kcal/mol:	38.66
Dipole, Da:	5.61
IP(EA), eV:	-8.98(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4,5-dibromo-1-(2-morpholin-4-yl-1,3-thiazol-4-yl)imidazole-2-carboxylate

Drug info:

PubChemData

Smile

C1COC(CN1C2=NC(=CS2)N3C=C(N=C3Br)Br)CC4=CC=CC=C4

DOS

IR

Vibrations