Geometry & MOs

Info

ID:	240751
PubChem CID:	93617279
Reduced:	SN2O5C14H22 (1)
Stoich.:	AB2C5D14E22 (1)
Weight, g/mol:	300.114378
ΔH_f, kcal/mol:	-182.84
Dipole, Da:	5.23
IP(EA), eV:	-9.56(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfonyl]-1-pyrrolidin-1-ylpropan-1-one

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CS(=O)(=O)[C@H](C)C(=O)NC[C@@H]2CCCO2

DOS

IR

Vibrations