Geometry & MOs

Info

ID:	192873
PubChem CID:	78321836
Reduced:	O3N5C19H23 (1)
Stoich.:	A3B5C19D23 (1)
Weight, g/mol:	371.141596
ΔH_f, kcal/mol:	-40.82
Dipole, Da:	3.69
IP(EA), eV:	-8.45(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[6-(5-propan-2-yloxy-1H-indazol-3-yl)pyrimidin-4-yl]-1,4-thiazinane 1-oxide

Drug info:

PubChemData

Smile

CC(C)OC1=CC2=C(C=C1)NN=C2C3=CC(=NC=N3)N4C[C@@H]([C@H](C4)OC)O

DOS

IR

Vibrations