Geometry & MOs

Info

ID:	370128
PubChem CID:	127337499
Reduced:	FO2N5C21H26 (1)
Stoich.:	AB2C5D21E26 (1)
Weight, g/mol:	388.29506
ΔH_f, kcal/mol:	-60.96
Dipole, Da:	7.95
IP(EA), eV:	-8.55(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-methyl-2-(3-methylpiperidin-1-yl)propyl]-3-[1-(6-methylpyridazin-3-yl)piperidin-3-yl]urea

Drug info:

PubChemData

Smile

CN(C1CCCN(C1)C2=NN=CC=C2)C(=O)NC3CCCOC4=C3C=C(C=C4)F

DOS

IR

Vibrations