Geometry & MOs

Info

ID:	72849
PubChem CID:	48416612
Reduced:	O3N4C19H22 (1)
Stoich.:	A3B4C19D22 (1)
Weight, g/mol:	415.221954
ΔH_f, kcal/mol:	-72.68
Dipole, Da:	4.72
IP(EA), eV:	-9.16(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[2-(4-methylpiperidin-1-yl)-5-nitrobenzoyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CC1=C(N=C(O1)C2=CC=CC=C2)C(=O)N3CCCC(C3)N4CCNC4=O

DOS

IR

Vibrations