Geometry & MOs

Info

ID:	349855
PubChem CID:	127276247
Reduced:	O2N5C22H33 (1)
Stoich.:	A2B5C22D33 (1)
Weight, g/mol:	343.192963
ΔH_f, kcal/mol:	-56.12
Dipole, Da:	8.92
IP(EA), eV:	-8.34(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,1-dioxo-1,4-thiazinan-4-yl)-1-[2-(piperidin-1-ylmethyl)pyrrolidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=C(C(=O)N=C2C1=C(NN2C)C)CCC(=O)N3CCCC3CN4CCCCC4

DOS

IR

Vibrations