Geometry & MOs

Info

ID:	339760
PubChem CID:	127261764
Reduced:	SN3O3C12H15 (1)
Stoich.:	AB3C3D12E15 (1)
Weight, g/mol:	228.022104
ΔH_f, kcal/mol:	-14.7
Dipole, Da:	7.81
IP(EA), eV:	-8.59(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-4-[(2,3-dichlorophenyl)methylidene]imidazolidine

Drug info:

PubChemData

Smile

CN\1CCN/C1=C(/[N+](=O)[O-])\SC2=CC=C(C=C2)OC

DOS

IR

Vibrations