Geometry & MOs

Info

ID:	330220
PubChem CID:	127247207
Reduced:	SO2N5C15H23 (1)
Stoich.:	AB2C5D15E23 (1)
Weight, g/mol:	338.104876
ΔH_f, kcal/mol:	-23.41
Dipole, Da:	4.48
IP(EA), eV:	-9.44(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-ethyl-1,2-oxazol-5-yl)-[3-(4-methylsulfonyl-1H-pyrazol-5-yl)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C)N1C(=CC=N1)CN2CCC(C2)C3=C(C=NN3)S(=O)(=O)C

DOS

IR

Vibrations