Geometry & MOs

Info

ID:	360873
PubChem CID:	127301527
Reduced:	SN3O4C11H15 (1)
Stoich.:	AB3C4D11E15 (1)
Weight, g/mol:	313.146013
ΔH_f, kcal/mol:	-64.98
Dipole, Da:	2.34
IP(EA), eV:	-10.16(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-[[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]sulfonylmethyl]-1,2-oxazole

Drug info:

PubChemData

Smile

CC1=NOC(=C1)CS(=O)(=O)NCC2=C(ON=C2C)C

DOS

IR

Vibrations