Geometry & MOs

Info

ID:	372079
PubChem CID:	131292920
Reduced:	ON4C11H14 (1)
Stoich.:	AB4C11D14 (1)
Weight, g/mol:	237.067094
ΔH_f, kcal/mol:	25.81
Dipole, Da:	7.04
IP(EA), eV:	-8.71(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-hydroxy-2-(1-methylsulfonylpyrrolidin-3-yl)acetate

Drug info:

PubChemData

Smile

CC1=CC(=NN1C)C(=O)C2=C(N(C=C2)C)N

DOS

IR

Vibrations