Geometry & MOs

Info

ID:	444654
PubChem CID:	135263144
Reduced:	N3O3C14H21 (1)
Stoich.:	A3B3C14D21 (1)
Weight, g/mol:	549.266128
ΔH_f, kcal/mol:	-114.56
Dipole, Da:	3.36
IP(EA), eV:	-8.79(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1,1-dioxo-1,4-thiazinan-4-yl)-3-methylphenyl]-N-[(5-methylfuran-2-yl)-(4-methyl-2-piperidin-1-ylphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)CC1=CN=C(N=C1)N2CCOCC2

DOS

IR

Vibrations