Geometry & MOs

Info

ID:	366084
PubChem CID:	127319417
Reduced:	SN2O3C18H20 (1)
Stoich.:	AB2C3D18E20 (1)
Weight, g/mol:	334.098728
ΔH_f, kcal/mol:	-93.35
Dipole, Da:	4.61
IP(EA), eV:	-9.35(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-5-methyl-2-phenyl-1,3-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=N1)C2=CC=CC=C2)C(=O)NC3CCCS(=O)(=O)C3

DOS

IR

Vibrations