Geometry & MOs

Info

ID:	441295
PubChem CID:	135233997
Reduced:	N3O3C11H19 (1)
Stoich.:	A3B3C11D19 (1)
Weight, g/mol:	350.126006
ΔH_f, kcal/mol:	-163.35
Dipole, Da:	0.5
IP(EA), eV:	-10.54(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-7-[2-oxo-2-(piperidin-4-ylamino)ethyl]-1,3-diazepan-1-yl] hydrogen sulfate

Drug info:

PubChemData

Smile

CCN1C(=O)N(C(=O)N(C1=O)CC(C)C)CC

DOS

IR

Vibrations