Geometry & MOs

Info

ID:	368302
PubChem CID:	127327890
Reduced:	OF2N4C18H20 (1)
Stoich.:	AB2C4D18E20 (1)
Weight, g/mol:	359.155767
ΔH_f, kcal/mol:	-58.91
Dipole, Da:	5.6
IP(EA), eV:	-9.24(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,6-difluorophenyl)cyclopropyl]-4-pyridazin-3-ylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C=N1)C2CCN(C2)C(=O)NC3CC3C4=C(C=CC=C4F)F

DOS

IR

Vibrations