Geometry & MOs

Info

ID:	449802
PubChem CID:	135301654
Reduced:	OSN7C18H27 (1)
Stoich.:	ABC7D18E27 (1)
Weight, g/mol:	439.165366
ΔH_f, kcal/mol:	18.34
Dipole, Da:	3.43
IP(EA), eV:	-8.31(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-[[2-[2-methyl-6-(trifluoromethyl)pyridin-4-yl]-2,7-diazaspiro[4.4]nonan-7-yl]methyl]-1,3-thiazol-2-yl]acetamide

Drug info:

PubChemData

Smile

CC(NC1=NC=C(S1)CN2CCC3(C2)CCN(C3)C4=NC(=CN=C4)NC)O

DOS

IR

Vibrations