Geometry & MOs

Info

ID:	428639
PubChem CID:	135167820
Reduced:	NC16H33 (1)
Stoich.:	AB16C33 (1)
Weight, g/mol:	418.355929
ΔH_f, kcal/mol:	-67.17
Dipole, Da:	1.99
IP(EA), eV:	-9.04(3.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-1-[2-[3-[5-[(2-methylpropan-2-yl)oxy]pentyl]phenoxy]ethyl]piperidin-3-amine

Drug info:

PubChemData

Smile

CCC(CC)C1CCCC(C1N)C(CC)CC

DOS

IR

Vibrations