Geometry & MOs

Info

ID:	371065
PubChem CID:	127342259
Reduced:	O2N5C20H25 (1)
Stoich.:	A2B5C20D25 (1)
Weight, g/mol:	399.162806
ΔH_f, kcal/mol:	-30.41
Dipole, Da:	3.97
IP(EA), eV:	-8.76(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]-2-methyl-1,1-dioxo-1,4-thiazinane-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCC1CN2C=CC=N2)C(=O)NC3CC(=O)N(C3)C4=CC=CC=C4

DOS

IR

Vibrations