Geometry & MOs

Info

ID:	415897
PubChem CID:	135088899
Reduced:	ON6C15H22 (1)
Stoich.:	AB6C15D22 (1)
Weight, g/mol:	344.096141
ΔH_f, kcal/mol:	25.91
Dipole, Da:	6.59
IP(EA), eV:	-9.04(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[(3R,4S)-3-hydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecan-4-yl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C3=NC=NC4=C3NC=N4)CO

DOS

IR

Vibrations