Geometry & MOs

Info

ID:	346158
PubChem CID:	127270646
Reduced:	ON2C10H15 (2)
Stoich.:	AB2C10D15 (2)
Weight, g/mol:	318.216809
ΔH_f, kcal/mol:	-51.05
Dipole, Da:	6.96
IP(EA), eV:	-8.81(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[cyclopropyl(ethyl)amino]ethyl]-4-pyridazin-3-ylpiperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCN(CCNC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)C)C3CC3

DOS

IR

Vibrations