Geometry & MOs

Info

ID:	222832
PubChem CID:	85332671
Reduced:	N2O8C29H46 (1)
Stoich.:	A2B8C29D46 (1)
Weight, g/mol:	550.31552
ΔH_f, kcal/mol:	-359.26
Dipole, Da:	2.84
IP(EA), eV:	-8.98(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[1-butyl-3-(1-hydroxy-2-methylpropyl)-2,5-dioxo-1,4,9-triazaspiro[5.5]undecan-9-yl]methyl]-N-(4-methoxyphenyl)benzamide

Drug info:

PubChemData

Smile

CC1CCC23CCC(=O)C2C1(C(CC(C(C3C)O)(C)C=C)OC(=O)NC(=O)OCC(CN4CCOCC4)O)C

DOS

IR

Vibrations