Geometry & MOs

Info

ID:	345296
PubChem CID:	127269530
Reduced:	N3O4C17H23 (1)
Stoich.:	A3B4C17D23 (1)
Weight, g/mol:	325.082934
ΔH_f, kcal/mol:	-161.39
Dipole, Da:	4.37
IP(EA), eV:	-8.33(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(2-oxopiperidin-3-yl)urea

Drug info:

PubChemData

Smile

CCOC1=C(C=C2C(=C1)CC(O2)C)NC(=O)NC3CCCNC3=O

DOS

IR

Vibrations