Geometry & MOs

Info

ID:	72902
PubChem CID:	48416666
Reduced:	ClFO3N4C18H22 (1)
Stoich.:	ABC3D4E18F22 (1)
Weight, g/mol:	410.15902
ΔH_f, kcal/mol:	-172.14
Dipole, Da:	6.54
IP(EA), eV:	-9.18(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(5-nitro-2-phenoxybenzoyl)piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)CCNC(=O)C2=C(C=C(C=C2)F)Cl)N3CCNC3=O

DOS

IR

Vibrations