Geometry & MOs

Info

ID:	156989
PubChem CID:	56404455
Reduced:	SN2O3C18H22 (1)
Stoich.:	AB2C3D18E22 (1)
Weight, g/mol:	381.194008
ΔH_f, kcal/mol:	-77.92
Dipole, Da:	2.62
IP(EA), eV:	-8.97(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzhydryloxy-1-[4-(1,3-dioxolan-2-yl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CN(CCC1C2OCCO2)C(=O)C3=CC=CN3CC4=CC=CS4

DOS

IR

Vibrations