Geometry & MOs

Info

ID:	203921
PubChem CID:	79891053
Reduced:	O2N3C14H19 (1)
Stoich.:	A2B3C14D19 (1)
Weight, g/mol:	313.055484
ΔH_f, kcal/mol:	-49.81
Dipole, Da:	2.24
IP(EA), eV:	-8.4(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methylsulfonylthiomorpholin-4-yl)-1,3-benzoxazol-5-amine

Drug info:

PubChemData

Smile

C1CC(C(C1)CO)CNC2=NC3=C(O2)C=CC(=C3)N

DOS

IR

Vibrations