Geometry & MOs

Info

ID:	246618
PubChem CID:	103061505
Reduced:	ON5C14H15 (1)
Stoich.:	AB5C14D15 (1)
Weight, g/mol:	243.183444
ΔH_f, kcal/mol:	43.7
Dipole, Da:	4.22
IP(EA), eV:	-8.88(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-ethoxypiperidin-1-yl)methyl]oxan-4-ol

Drug info:

PubChemData

Smile

C1CN(C(=O)C2=CC=CC=C21)CC3=CN=C(C=N3)NN

DOS

IR

Vibrations