Geometry & MOs

Info

ID:	148320
PubChem CID:	53787982
Reduced:	O3C25H48 (1)
Stoich.:	A3B25C48 (1)
Weight, g/mol:	503.153118
ΔH_f, kcal/mol:	-212.34
Dipole, Da:	3.13
IP(EA), eV:	-9.55(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-benzyl-2-(quinolin-2-ylmethylamino)piperidin-1-yl]-(3,5-dichlorophenyl)methanone

Drug info:

PubChemData

Smile

CCCCCCCCC=CCCCCCCCCCCCC(=O)OCCOC

DOS

IR

Vibrations