Geometry & MOs

Info

ID:	49549
PubChem CID:	11533218
Reduced:	O2N5H25C30 (1)
Stoich.:	A2B5C25D30 (1)
Weight, g/mol:	487.177707
ΔH_f, kcal/mol:	66.16
Dipole, Da:	4.17
IP(EA), eV:	-8.68(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[dimethylsulfamoyl-[1-[3-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methoxy]phenyl]ethyl]amino]acetic acid

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)NC2=CC(=CC=C2)OCC3=CC=CC=C3)NC4=C(C=CC=N4)C5=NC=NC=C5

DOS

IR

Vibrations