Geometry & MOs

Info

ID:	72792
PubChem CID:	48416550
Reduced:	N4O5C21H26 (1)
Stoich.:	A4B5C21D26 (1)
Weight, g/mol:	377.140927
ΔH_f, kcal/mol:	-181.28
Dipole, Da:	3.96
IP(EA), eV:	-8.3(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2CC(=O)N(C2)C3=CC4=C(C=C3)OCCO4)N5CCNC5=O

DOS

IR

Vibrations