Geometry & MOs

Info

ID:	240752
PubChem CID:	93617284
Reduced:	SN2O4C13H20 (1)
Stoich.:	AB2C4D13E20 (1)
Weight, g/mol:	328.145678
ΔH_f, kcal/mol:	-136.68
Dipole, Da:	10.53
IP(EA), eV:	-9.52(0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-(cyclohexylmethyl)-2-[(3-methyl-1,2-oxazol-5-yl)methylsulfonyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CS(=O)(=O)[C@@H](C)C(=O)N2CCCC2

DOS

IR

Vibrations