Geometry & MOs

Info

ID:	258486
PubChem CID:	103154405
Reduced:	N2O2C15H22 (1)
Stoich.:	A2B2C15D22 (1)
Weight, g/mol:	243.194677
ΔH_f, kcal/mol:	-72.29
Dipole, Da:	4.71
IP(EA), eV:	-9.22(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-1-[4-(dimethylamino)piperidin-1-yl]-3-methoxybutan-1-one

Drug info:

PubChemData

Smile

CN(C1CCC2=CC=CC=C12)C(=O)CC(CN)OC

DOS

IR

Vibrations