Geometry & MOs

Info

ID:	434371
PubChem CID:	135174804
Reduced:	ON3C11H17 (1)
Stoich.:	AB3C11D17 (1)
Weight, g/mol:	417.287909
ΔH_f, kcal/mol:	-8.4
Dipole, Da:	2.38
IP(EA), eV:	-9.31(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(2-methylbutan-2-yloxy)cyclobutyl]oxy-2-[3-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethoxy]but-1-ynyl]pyridine

Drug info:

PubChemData

Smile

CC(C)C1=CN=C(C=N1)OC2CC(C2)N

DOS

IR

Vibrations