Geometry & MOs

Info

ID:	343445
PubChem CID:	127266618
Reduced:	O2N3F5H10C13 (1)
Stoich.:	A2B3C5D10E13 (1)
Weight, g/mol:	349.109627
ΔH_f, kcal/mol:	-248.19
Dipole, Da:	3.71
IP(EA), eV:	-10.25(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]phenyl]methyl]-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C1=NC(=NO1)C(F)(F)F)NC(=O)CC2=C(C=CC=C2F)F

DOS

IR

Vibrations