Geometry & MOs

Info

ID:	221888
PubChem CID:	85292117
Reduced:	NO6H15C17 (1)
Stoich.:	AB6C15D17 (1)
Weight, g/mol:	331.115462
ΔH_f, kcal/mol:	-82.26
Dipole, Da:	4.99
IP(EA), eV:	-8.58(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-fluorophenyl)-5-(2-propan-2-yloxypyridin-4-yl)imidazolidine-2-thione

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C=CC2=CC3=C(C(=C2)OC)OCO3)[N+](=O)[O-]

DOS

IR

Vibrations