Geometry & MOs

Info

ID:	269165
PubChem CID:	103616176
Reduced:	ON2C13H28 (1)
Stoich.:	AB2C13D28 (1)
Weight, g/mol:	275.163377
ΔH_f, kcal/mol:	-93.21
Dipole, Da:	2.76
IP(EA), eV:	-9.04(1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-methyl-3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbonyl)-1H-pyridazin-6-one

Drug info:

PubChemData

Smile

CC(C)CCCCCCNCCC(=O)NC

DOS

IR

Vibrations