Geometry & MOs

Info

ID:	207108
PubChem CID:	80347980
Reduced:	NOC7H10 (2)
Stoich.:	ABC7D10 (2)
Weight, g/mol:	278.185509
ΔH_f, kcal/mol:	-62.81
Dipole, Da:	2.31
IP(EA), eV:	-8.86(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-(2-aminoethyl)piperazin-1-yl]-N,N-dimethylpyridazine-3-carboxamide

Drug info:

PubChemData

Smile

CC(=O)CC1CCCN1CC2=C(N=CC=C2)OC

DOS

IR

Vibrations