Geometry & MOs

Info

ID:	67664
PubChem CID:	46506922
Reduced:	ClN2S2O3H23C26 (1)
Stoich.:	AB2C2D3E23F26 (1)
Weight, g/mol:	324.093249
ΔH_f, kcal/mol:	-29.07
Dipole, Da:	3.21
IP(EA), eV:	-9.15(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methylphenyl)sulfanyl-N-(4-phenyl-1,2-oxazol-5-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N(C)S(=O)(=O)C2=C(SC=C2C3=CC=CC=C3)C(=O)NCC4=CC=C(C=C4)Cl

DOS

IR

Vibrations