Geometry & MOs

Info

ID:	421775
PubChem CID:	135116598
Reduced:	FN2O3C22H33 (1)
Stoich.:	AB2C3D22E33 (1)
Weight, g/mol:	380.151826
ΔH_f, kcal/mol:	-188.4
Dipole, Da:	2.31
IP(EA), eV:	-8.77(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1,1-dioxo-1,4-thiazinan-4-yl)methyl]-N-[2-(2-oxoimidazolidin-1-yl)ethyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)N2CCC(CC2)N3CCC4(CC3)[C@H]([C@](CCO4)(C)O)O

DOS

IR

Vibrations