Geometry & MOs

Info

ID:	449800
PubChem CID:	135301605
Reduced:	O2F4N7C26H27 (1)
Stoich.:	A2B4C7D26E27 (1)
Weight, g/mol:	345.241627
ΔH_f, kcal/mol:	-157.79
Dipole, Da:	12.39
IP(EA), eV:	-8.79(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 7-(2-ethyl-6-methylpyridin-4-yl)-2,7-diazaspiro[4.4]nonane-2-carboxylate

Drug info:

PubChemData

Smile

CC#CC(=O)N1CCCC(CCC1)N2C(=C(C(=N2)C3=CN(N=C3)CC4=C(C(=CC=C4)F)C(F)(F)F)C(=O)N)N

DOS

IR

Vibrations