Geometry & MOs

Info

ID:	207117
PubChem CID:	80349568
Reduced:	ON5C13H21 (1)
Stoich.:	AB5C13D21 (1)
Weight, g/mol:	263.17461
ΔH_f, kcal/mol:	1.43
Dipole, Da:	4.77
IP(EA), eV:	-8.68(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,2-dimethylpiperazin-1-yl)-N-ethylpyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CC1CNC(CN1C2=NN=C(C=C2)C(=O)N(C)C)C

DOS

IR

Vibrations