Geometry & MOs

Info

ID:	369975
PubChem CID:	127336984
Reduced:	N3O4C18H31 (1)
Stoich.:	A3B4C18D31 (1)
Weight, g/mol:	271.135448
ΔH_f, kcal/mol:	-205.88
Dipole, Da:	7.01
IP(EA), eV:	-9.06(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dimethyl-4-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]-1,4-thiazinane 1-oxide

Drug info:

PubChemData

Smile

C1CCN(C1)C(=O)N2CCC(CC2)C(=O)NCC(C3CCOCC3)O

DOS

IR

Vibrations