Geometry & MOs

Info

ID:	347715
PubChem CID:	127272777
Reduced:	NOSC10H19 (1)
Stoich.:	ABCD10E19 (1)
Weight, g/mol:	249.147727
ΔH_f, kcal/mol:	-74.57
Dipole, Da:	2.83
IP(EA), eV:	-8.66(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4,4-dimethylpiperidine-1-carbonyl)-2-methylpyridazin-3-one

Drug info:

PubChemData

Smile

CC1(CCN(CC1)C(=O)CSC)C

DOS

IR

Vibrations