Geometry & MOs

Info

ID:	82934
PubChem CID:	49856841
Reduced:	NOC12H15 (2)
Stoich.:	ABC12D15 (2)
Weight, g/mol:	330.230728
ΔH_f, kcal/mol:	-37.18
Dipole, Da:	3.39
IP(EA), eV:	-8.91(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-piperidin-1-yl-1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]ethanone

Drug info:

PubChemData

Smile

C1CCN(C1)CCCOC2=CC=C(C=C2)C(=O)CN3CCC4=CC=CC=C4C3

DOS

IR

Vibrations