Geometry & MOs

Info

ID:	309114
PubChem CID:	126537663
Reduced:	N2O4C21H32 (1)
Stoich.:	A2B4C21D32 (1)
Weight, g/mol:	187.0667
ΔH_f, kcal/mol:	-200.99
Dipole, Da:	4.08
IP(EA), eV:	-9.44(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E,5E)-4,5-di(ethylidene)thiazinane 1,1-dioxide

Drug info:

PubChemData

Smile

C[C@@H]1CCC[C@@H](C2=CC=CC(=C2)CC(NC1=O)CO)NC(=O)OC(C)(C)C

DOS

IR

Vibrations