Geometry & MOs

Info

ID:	371145
PubChem CID:	127342589
Reduced:	SO2N3C14H19 (1)
Stoich.:	AB2C3D14E19 (1)
Weight, g/mol:	257.119798
ΔH_f, kcal/mol:	-67.25
Dipole, Da:	2.59
IP(EA), eV:	-9.06(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(1-methyl-2-oxopyrrolidin-3-yl)thiomorpholine-4-carboxamide

Drug info:

PubChemData

Smile

CC1C2=C(CCN1C(=O)NC3CCN(C3=O)C)SC=C2

DOS

IR

Vibrations