Geometry & MOs

Info

ID:	343229
PubChem CID:	127266402
Reduced:	SO2N5C16H17 (1)
Stoich.:	AB2C5D16E17 (1)
Weight, g/mol:	344.130697
ΔH_f, kcal/mol:	-4.04
Dipole, Da:	6.11
IP(EA), eV:	-9.18(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-cyanoanilino)-N-[2-hydroxy-1-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide

Drug info:

PubChemData

Smile

CC1=NC(=CS1)C2=CC=C(C=C2)C(=O)NC(C)C3=NNC(=O)N3C

DOS

IR

Vibrations