Geometry & MOs

Info

ID:	227808
PubChem CID:	87562548
Reduced:	ClOSN5C24H34 (1)
Stoich.:	ABCD5E24F34 (1)
Weight, g/mol:	231.162314
ΔH_f, kcal/mol:	-30.83
Dipole, Da:	5.66
IP(EA), eV:	-8.24(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenyl-2-propylpiperidine-1-carbaldehyde

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)N2CCC(CC2)N3CCN(CC3)C4=CC=C(C=C4)N(C(=O)N)S.Cl

DOS

IR

Vibrations