Geometry & MOs

Info

ID:	353160
PubChem CID:	127284340
Reduced:	O2N5C20H21 (1)
Stoich.:	A2B5C20D21 (1)
Weight, g/mol:	379.156577
ΔH_f, kcal/mol:	4.0
Dipole, Da:	3.65
IP(EA), eV:	-8.93(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=NN(C2=C1C=CC(=N2)C(=O)N3CCCC3C(=O)NC)C4=CC=CC=C4

DOS

IR

Vibrations