Geometry & MOs

Info

ID:	158637
PubChem CID:	56464359
Reduced:	SN2O2C9H11 (2)
Stoich.:	AB2C2D9E11 (2)
Weight, g/mol:	428.242356
ΔH_f, kcal/mol:	-132.44
Dipole, Da:	5.79
IP(EA), eV:	-8.49(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-5-methylphenyl)-2-(8-tert-butyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C)NC(=O)C2=CC(=CN2)S(=O)(=O)N3CCSCC3

DOS

IR

Vibrations