Geometry & MOs

Info

ID:	352645
PubChem CID:	127283734
Reduced:	O2N3C17H21 (1)
Stoich.:	A2B3C17D21 (1)
Weight, g/mol:	360.179755
ΔH_f, kcal/mol:	-24.5
Dipole, Da:	4.46
IP(EA), eV:	-8.96(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[3-[4-(hydroxymethyl)piperidine-1-carbonyl]anilino]acetyl]imidazolidin-2-one

Drug info:

PubChemData

Smile

C1CC(C1)(C#N)NC(=O)C2=CC=CC(=C2)CN3CCOCC3

DOS

IR

Vibrations