Geometry & MOs

Info

ID:	204081
PubChem CID:	79908777
Reduced:	O2N4C13H22 (1)
Stoich.:	A2B4C13D22 (1)
Weight, g/mol:	280.189926
ΔH_f, kcal/mol:	-43.59
Dipole, Da:	5.12
IP(EA), eV:	-9.23(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methoxy-N-[[1-(5-oxaspiro[3.5]nonan-8-yl)triazol-4-yl]methyl]ethanamine

Drug info:

PubChemData

Smile

CCNCC1=CN(N=N1)C2CCOC3(C2)CCOC3

DOS

IR

Vibrations