Geometry & MOs

Info

ID:	322870
PubChem CID:	126671493
Reduced:	NOF2C13H27 (1)
Stoich.:	ABC2D13E27 (1)
Weight, g/mol:	550.43591
ΔH_f, kcal/mol:	-208.13
Dipole, Da:	4.72
IP(EA), eV:	-8.96(2.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-1-[5-[5-[[1-(5-tert-butylpyridin-2-yl)azetidin-3-yl]amino]-2,2,5-trimethylhexoxy]pyridin-2-yl]azetidin-3-amine

Drug info:

PubChemData

Smile

CC(C)(C)NCCC(CCOC(C)(C)C)(F)F

DOS

IR

Vibrations