Geometry & MOs

Info

ID:	203970
PubChem CID:	79894521
Reduced:	NO3C16H27 (1)
Stoich.:	AB3C16D27 (1)
Weight, g/mol:	241.204179
ΔH_f, kcal/mol:	-163.3
Dipole, Da:	3.76
IP(EA), eV:	-8.92(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-oxaspiro[3.5]nonan-8-yloxy)-N-propan-2-ylpropan-1-amine

Drug info:

PubChemData

Smile

CC1(CCCN(C1)C2CCOC3(C2)CCCC3)C(=O)O

DOS

IR

Vibrations