Geometry & MOs

Info

ID:	431363
PubChem CID:	135171438
Reduced:	OBr2S2N4C15H18 (1)
Stoich.:	AB2C2D4E15F18 (1)
Weight, g/mol:	485.95476
ΔH_f, kcal/mol:	17.32
Dipole, Da:	3.48
IP(EA), eV:	-8.38(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(2,4-dibromo-3-methyl-2H-imidazol-1-yl)-1,3-thiazol-2-yl]-2-phenylmorpholine

Drug info:

PubChemData

Smile

CN1C(N(C=C1Br)C2=CSC(=N2)N3CCOC(C3)C4CC=CS4)Br

DOS

IR

Vibrations