Geometry & MOs

Info

ID:	351226
PubChem CID:	127279784
Reduced:	N4O4C17H26 (1)
Stoich.:	A4B4C17D26 (1)
Weight, g/mol:	345.18009
ΔH_f, kcal/mol:	-131.88
Dipole, Da:	3.5
IP(EA), eV:	-9.21(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5,6-trimethyl-4-[3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]piperidine-1-carbonyl]pyridazin-3-one

Drug info:

PubChemData

Smile

CC1=NC(=NO1)CC2CCCN(C2)C(=O)C3CC(=O)N(C3)CCOC

DOS

IR

Vibrations