Geometry & MOs

Info

ID:	388195
PubChem CID:	134988497
Reduced:	NSO2C13H19 (1)
Stoich.:	ABC2D13E19 (1)
Weight, g/mol:	376.98103
ΔH_f, kcal/mol:	-81.6
Dipole, Da:	5.56
IP(EA), eV:	-8.65(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethoxy-1-methyl-3,4-dihydropyrrol-1-ium-2-one;hexafluoroantimony(1-)

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)[S@](=O)N(C(=O)C)C(C)(C)C

DOS

IR

Vibrations