Geometry & MOs

Info

ID:	302692
PubChem CID:	124391995
Reduced:	SN2O5C16H24 (1)
Stoich.:	AB2C5D16E24 (1)
Weight, g/mol:	339.025813
ΔH_f, kcal/mol:	-190.87
Dipole, Da:	8.41
IP(EA), eV:	-9.06(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(4E)-4-[(4-chloro-3-nitrophenyl)methylidene]-2,5-dioxoimidazolidin-1-yl]acetate

Drug info:

PubChemData

Smile

C[C@H](C(=O)NC1CCCC1)NS(=O)(=O)C2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations