Geometry & MOs

Info

ID:	278095
PubChem CID:	103833339
Reduced:	BrON3H12C13 (1)
Stoich.:	ABC3D12E13 (1)
Weight, g/mol:	275.109233
ΔH_f, kcal/mol:	2.82
Dipole, Da:	6.16
IP(EA), eV:	-8.72(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-amino-2-phenyl-N-[2-(1,3-thiazol-2-yl)propan-2-yl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)CC(=O)NC2=CN=C(C=C2)Br)N

DOS

IR

Vibrations