Geometry & MOs

Info

ID:	282509
PubChem CID:	103928970
Reduced:	OBr2N2C12H16 (1)
Stoich.:	AB2C2D12E16 (1)
Weight, g/mol:	291.0041
ΔH_f, kcal/mol:	-41.48
Dipole, Da:	2.84
IP(EA), eV:	-9.33(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-N-(5-bromo-1,3-thiazol-2-yl)-3,3-dimethylbutanamide

Drug info:

PubChemData

Smile

CC(C)(C)[C@H](C(=O)NC1=C(C=CC(=C1)Br)Br)N

DOS

IR

Vibrations