Geometry & MOs

Info

ID:	359761
PubChem CID:	127299708
Reduced:	SN2O5C18H30 (1)
Stoich.:	AB2C5D18E30 (1)
Weight, g/mol:	383.151492
ΔH_f, kcal/mol:	-260.74
Dipole, Da:	6.32
IP(EA), eV:	-9.87(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(1,1-dioxothiolan-3-yl)-1-N-[(3-methyl-1,2-oxazol-5-yl)methyl]cyclohexane-1,2-dicarboxamide

Drug info:

PubChemData

Smile

C1CCC(C(C1)C(=O)NCC2CCCCO2)C(=O)NC3CCS(=O)(=O)C3

DOS

IR

Vibrations