Geometry & MOs

Info

ID:	246624
PubChem CID:	103061546
Reduced:	ClNO2C15H22 (1)
Stoich.:	ABC2D15E22 (1)
Weight, g/mol:	282.230728
ΔH_f, kcal/mol:	-90.27
Dipole, Da:	2.71
IP(EA), eV:	-8.81(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]methyl]oxan-4-ol

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1Cl)N(C)CC2COCCC2O

DOS

IR

Vibrations