Geometry & MOs

Info

ID:	414821
PubChem CID:	135087784
Reduced:	ClSO3N4C11H17 (1)
Stoich.:	ABC3D4E11F17 (1)
Weight, g/mol:	396.204907
ΔH_f, kcal/mol:	-88.84
Dipole, Da:	5.1
IP(EA), eV:	-8.97(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-benzyl-3-(2,5-dimethylfuran-3-carbonyl)-7-oxa-3,11-diazaspiro[5.6]dodecan-10-one

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C[C@@H]1COC[C@H]1NC2=NC=C(C=N2)Cl

DOS

IR

Vibrations