Geometry & MOs

Info

ID:	173049
PubChem CID:	75589667
Reduced:	O3N4C12H22 (1)
Stoich.:	A3B4C12D22 (1)
Weight, g/mol:	313.142641
ΔH_f, kcal/mol:	-89.06
Dipole, Da:	3.26
IP(EA), eV:	-9.28(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-N-[(3-ethoxyphenyl)methyl]-6-oxo-3H-pyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CN(CCOC)C(=O)C(COC)N

DOS

IR

Vibrations