Geometry & MOs

Info

ID:	83009
PubChem CID:	49856991
Reduced:	NOC8H12 (2)
Stoich.:	ABC8D12 (2)
Weight, g/mol:	404.212211
ΔH_f, kcal/mol:	-95.21
Dipole, Da:	3.95
IP(EA), eV:	-9.3(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-amino-5-deuterio-1,3-thiazol-4-yl)-N-[2,3,5,6-tetradeuterio-4-[2,2-dideuterio-2-[[(2R)-2-deuterio-2-hydroxy-2-phenylethyl]amino]ethyl]phenyl]acetamide

Drug info:

PubChemData

Smile

C1CCC(CC1)NC(=O)OCC(CC2=CC=CC=C2)N

DOS

IR

Vibrations