Geometry & MOs

Info

ID:	352735
PubChem CID:	127283824
Reduced:	SN3O4C15H19 (1)
Stoich.:	AB3C4D15E19 (1)
Weight, g/mol:	259.099063
ΔH_f, kcal/mol:	-99.02
Dipole, Da:	4.39
IP(EA), eV:	-8.53(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclopropylcarbamoyl)-2-(1-oxo-1,4-thiazinan-4-yl)acetamide

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)C(=O)N=C(N2)CN3CCS(=O)CC3)OC

DOS

IR

Vibrations