Geometry & MOs

Info

ID:	322943
PubChem CID:	126671626
Reduced:	ON2C9H20 (1)
Stoich.:	AB2C9D20 (1)
Weight, g/mol:	516.440327
ΔH_f, kcal/mol:	-36.68
Dipole, Da:	2.66
IP(EA), eV:	-8.99(1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-N-[5-[6-[3-(tert-butylamino)cyclobutyl]oxypyridin-3-yl]-2,5-dimethylhexan-2-yl]-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidin-3-amine

Drug info:

PubChemData

Smile

CC(C)C(=NC)ONC(C)(C)C

DOS

IR

Vibrations