Geometry & MOs

Info

ID:	68496
PubChem CID:	46508524
Reduced:	F3N3O4C22H26 (1)
Stoich.:	A3B3C4D22E26 (1)
Weight, g/mol:	396.146741
ΔH_f, kcal/mol:	-254.87
Dipole, Da:	2.87
IP(EA), eV:	-8.31(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-(2,6-dimethylmorpholin-4-yl)sulfonylanilino]acetyl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CCOC1=CC(=C(C=C1NC(=O)CNC2=C(C(=C(C=C2)F)F)F)OCC)N3CCOCC3

DOS

IR

Vibrations