Geometry & MOs

Info

ID:	218363
PubChem CID:	85089231
Reduced:	ON8C25H28 (1)
Stoich.:	AB8C25D28 (1)
Weight, g/mol:	452.151826
ΔH_f, kcal/mol:	175.71
Dipole, Da:	6.32
IP(EA), eV:	-8.7(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-ethyl-3-(4-hydroxy-4-methyl-1,2-oxazolidine-2-carbonyl)-2-(1H-indol-3-ylmethyl)-5-methylthieno[2,3-d]pyridazin-4-one

Drug info:

PubChemData

Smile

CCCCC1=NC(=CN1CC2=CC=C(C=C2)C3=CC=C(C=C3)C4NNNN4)C5=NC=CC=[N+]5[O-]

DOS

IR

Vibrations