Geometry & MOs

Info

ID:	177996
PubChem CID:	76261425
Reduced:	ClN4O4H21C24 (1)
Stoich.:	AB4C4D21E24 (1)
Weight, g/mol:	441.237604
ΔH_f, kcal/mol:	-41.37
Dipole, Da:	6.94
IP(EA), eV:	-8.94(-1.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(4-ethyl-6-oxo-1,3-diazinan-2-yl)phenyl]-2-(1-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide

Drug info:

PubChemData

Smile

CCCN(CC1=NC(=O)C2C=CC(=CC2=N1)Cl)C(=O)C3=CC(=CC=C3)NC(=O)C4=CC=CO4

DOS

IR

Vibrations