Geometry & MOs

Info

ID:	350272
PubChem CID:	127277350
Reduced:	N2O3C13H22 (1)
Stoich.:	A2B3C13D22 (1)
Weight, g/mol:	386.243024
ΔH_f, kcal/mol:	-157.22
Dipole, Da:	1.75
IP(EA), eV:	-9.41(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methylpiperazin-1-yl)-[1-(6-pyrrolidin-1-ylpyridazine-3-carbonyl)piperidin-4-yl]methanone

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)CNC(=O)C2CCCOC2

DOS

IR

Vibrations