Geometry & MOs

Info

ID:	353799
PubChem CID:	127285435
Reduced:	FSN2O3C14H19 (1)
Stoich.:	ABC2D3E14F19 (1)
Weight, g/mol:	261.139865
ΔH_f, kcal/mol:	-148.91
Dipole, Da:	4.99
IP(EA), eV:	-9.28(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-methylbutylsulfonyl)-3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine

Drug info:

PubChemData

Smile

C1CCN(C1)S(=O)(=O)NC2CCCOC3=C2C=C(C=C3)F

DOS

IR

Vibrations