Geometry & MOs

Info

ID:	157333
PubChem CID:	56422892
Reduced:	N3O5C22H25 (1)
Stoich.:	A3B5C22D25 (1)
Weight, g/mol:	356.184841
ΔH_f, kcal/mol:	-140.58
Dipole, Da:	3.43
IP(EA), eV:	-8.28(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(1-ethyl-2,5-dimethylpyrrol-3-yl)-2-oxoethyl] 6-pyrrolidin-1-ylpyridazine-3-carboxylate

Drug info:

PubChemData

Smile

CCCOC1=CC=C(C=C1)OCCOC(=O)CCNC(=O)C2=NNC3=CC=CC=C32

DOS

IR

Vibrations