Geometry & MOs

Info

ID:	371479
PubChem CID:	127346549
Reduced:	ClO2N3C20H26 (1)
Stoich.:	AB2C3D20E26 (1)
Weight, g/mol:	257.108565
ΔH_f, kcal/mol:	-73.18
Dipole, Da:	5.84
IP(EA), eV:	-8.66(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohex-3-en-1-yl-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)methanone

Drug info:

PubChemData

Smile

C1CN(CCC1NC(=O)CC2=CNC3=C2C=C(C=C3)Cl)CC4CCOC4

DOS

IR

Vibrations