Geometry & MOs

Info

ID:	260432
PubChem CID:	103191198
Reduced:	ON5C15H27 (1)
Stoich.:	AB5C15D27 (1)
Weight, g/mol:	256.215078
ΔH_f, kcal/mol:	-19.33
Dipole, Da:	3.33
IP(EA), eV:	-8.77(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[1-(dimethylamino)propan-2-yl-ethylamino]methyl]oxane-4-carbaldehyde

Drug info:

PubChemData

Smile

CCC1=NC(=CC(=C1)C(=O)N(CC)C(C)CN(C)C)NN

DOS

IR

Vibrations