Geometry & MOs

Info

ID:	434529
PubChem CID:	135175137
Reduced:	N3O7C18H37 (1)
Stoich.:	A3B7C18D37 (1)
Weight, g/mol:	409.366828
ΔH_f, kcal/mol:	-331.65
Dipole, Da:	10.14
IP(EA), eV:	-9.04(1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-methylbutan-2-yl)-4-[2-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]ethyl]piperazine

Drug info:

PubChemData

Smile

CNC(=O)COCCCOCN(C)C(CCOCCNC(=O)CCCOC)O

DOS

IR

Vibrations