Geometry & MOs

Info

ID:	72562
PubChem CID:	48416307
Reduced:	ClFO3N4C19H20 (1)
Stoich.:	ABC3D4E19F20 (1)
Weight, g/mol:	366.205576
ΔH_f, kcal/mol:	-104.24
Dipole, Da:	5.68
IP(EA), eV:	-9.33(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[4-(2,5-dimethylpyrrol-1-yl)benzoyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C2=C(C=CC=C2Cl)F)C(=O)N3CCCC(C3)N4CCNC4=O

DOS

IR

Vibrations