Geometry & MOs

Info

ID:	177220
PubChem CID:	76147612
Reduced:	N2O2S2H16C17 (1)
Stoich.:	A2B2C2D16E17 (1)
Weight, g/mol:	294.103814
ΔH_f, kcal/mol:	-7.85
Dipole, Da:	2.98
IP(EA), eV:	-9.1(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-hydroxy-2-(3-methylthiophen-2-yl)ethyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C(CNC(=O)C2=CSC(=N2)C3=CC=CC=C3)O

DOS

IR

Vibrations