Geometry & MOs

Info

ID:	364759
PubChem CID:	127316090
Reduced:	ON7C13H19 (1)
Stoich.:	AB7C13D19 (1)
Weight, g/mol:	341.152161
ΔH_f, kcal/mol:	46.24
Dipole, Da:	2.97
IP(EA), eV:	-9.34(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,1-dioxo-1,4-thiazinan-4-yl)-1-[4-(1H-imidazol-2-ylmethyl)piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CN(CCN1CC2=NC=CN2)C(=O)CCN3C=CN=N3

DOS

IR

Vibrations