Geometry & MOs

Info

ID:	359939
PubChem CID:	127300073
Reduced:	SO3N4C14H24 (1)
Stoich.:	AB3C4D14E24 (1)
Weight, g/mol:	327.161663
ΔH_f, kcal/mol:	-96.53
Dipole, Da:	12.11
IP(EA), eV:	-9.18(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3,5-trimethyl-4-[1-(oxolan-3-ylmethylsulfonyl)pyrrolidin-2-yl]pyrazole

Drug info:

PubChemData

Smile

CCN1C=NN=C1C2CCCN(C2)S(=O)(=O)CC3CCOC3

DOS

IR

Vibrations