Geometry & MOs

Info

ID:	370776
PubChem CID:	127340556
Reduced:	O2N3C20H35 (1)
Stoich.:	A2B3C20D35 (1)
Weight, g/mol:	343.192963
ΔH_f, kcal/mol:	-130.01
Dipole, Da:	2.07
IP(EA), eV:	-8.79(0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-cyclopentyl-1,4-diazepan-1-yl)-2-(1,1-dioxo-1,4-thiazinan-4-yl)ethanone

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCN(CC1)C2CCCC2)NC(=O)C3CCCCC3

DOS

IR

Vibrations