Geometry & MOs

Info

ID:	418323
PubChem CID:	135104189
Reduced:	ClFSN2O4C14H18 (1)
Stoich.:	ABCD2E4F14G18 (1)
Weight, g/mol:	366.124943
ΔH_f, kcal/mol:	-200.01
Dipole, Da:	8.46
IP(EA), eV:	-9.6(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[(4R,5S)-4-hydroxy-7-azaspiro[4.5]decan-7-yl]sulfonyl]-4H-1,4-benzoxazin-3-one

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C[C@@H]1COC[C@H]1NC(=O)C2=C(C(=CC=C2)Cl)F

DOS

IR

Vibrations