Geometry & MOs

Info

ID:	370204
PubChem CID:	127337735
Reduced:	O2N5C18H35 (1)
Stoich.:	A2B5C18D35 (1)
Weight, g/mol:	361.259009
ΔH_f, kcal/mol:	-99.85
Dipole, Da:	4.0
IP(EA), eV:	-8.41(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1,4-dimethylpiperazin-2-yl)methyl]-3-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]urea

Drug info:

PubChemData

Smile

CN1CCN(C(C1)CNC(=O)N2CCN(CC2)CC3CCOCC3)C

DOS

IR

Vibrations