Geometry & MOs

Info

ID:	173045
PubChem CID:	75588997
Reduced:	N3O4H19C20 (1)
Stoich.:	A3B4C19D20 (1)
Weight, g/mol:	384.216141
ΔH_f, kcal/mol:	-43.8
Dipole, Da:	9.0
IP(EA), eV:	-8.86(-2.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[3-(6-oxo-1,3-diazinan-4-yl)piperidine-1-carbonyl]phenyl]cyclobutanecarboxamide

Drug info:

PubChemData

Smile

C1CC2(CCN(C1)C(=O)CC3=CC(=O)N=NC3=O)C=CC4=CC=CC=C4O2

DOS

IR

Vibrations