Geometry & MOs

Info

ID:	123327
PubChem CID:	50842501
Reduced:	O2N3C20H23 (1)
Stoich.:	A2B3C20D23 (1)
Weight, g/mol:	451.042726
ΔH_f, kcal/mol:	-44.81
Dipole, Da:	5.27
IP(EA), eV:	-8.93(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[(E)-2-[5-[(2-chloro-4-methylphenyl)sulfamoyl]thiophen-2-yl]ethenyl]-3-methyl-1,2-oxazol-4-yl]acetamide

Drug info:

PubChemData

Smile

CC1=NC2=CC(=CC(=C2C=C1)C(=O)NC3CCCC3)NC(=O)C4CC4

DOS

IR

Vibrations