Geometry & MOs

Info

ID:	212305
PubChem CID:	81060085
Reduced:	N2O2C17H18 (1)
Stoich.:	A2B2C17D18 (1)
Weight, g/mol:	265.088498
ΔH_f, kcal/mol:	-14.06
Dipole, Da:	4.24
IP(EA), eV:	-9.14(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1,1-dioxo-1,4-thiazinan-4-yl)-2,6-dimethylpyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CCCOC1=CC=CC=C1OC2=C(C(=NC(=C2)C)C)C#N

DOS

IR

Vibrations