Geometry & MOs

Info

ID:	364550
PubChem CID:	127315802
Reduced:	SN2O3C15H26 (1)
Stoich.:	AB2C3D15E26 (1)
Weight, g/mol:	285.04767
ΔH_f, kcal/mol:	-162.59
Dipole, Da:	8.66
IP(EA), eV:	-9.14(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-methyl-5-(2-methylpiperidin-1-yl)pyridazin-3-one

Drug info:

PubChemData

Smile

CC1(CCOC1)CNC(=O)CSCC(=O)N2CCCCC2

DOS

IR

Vibrations