Geometry & MOs

Info

ID:	78548
PubChem CID:	49693580
Reduced:	S2N3O4C14H17 (1)
Stoich.:	A2B3C4D14E17 (1)
Weight, g/mol:	276.093249
ΔH_f, kcal/mol:	-72.89
Dipole, Da:	5.77
IP(EA), eV:	-9.42(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methyl-1,2-oxazol-5-yl)-4-propan-2-ylsulfanylbenzamide

Drug info:

PubChemData

Smile

CC1=NOC(=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

DOS

IR

Vibrations