Geometry & MOs

Info

ID:	345292
PubChem CID:	127269526
Reduced:	O2N6C19H22 (1)
Stoich.:	A2B6C19D22 (1)
Weight, g/mol:	315.180758
ΔH_f, kcal/mol:	-6.83
Dipole, Da:	10.43
IP(EA), eV:	-8.3(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-propylpyrazol-3-yl)-4-pyridazin-3-ylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)N3CCN(CC3)C4=NN=CC=C4

DOS

IR

Vibrations