Geometry & MOs

Info

ID:	394765
PubChem CID:	135023718
Reduced:	N4O4C11H20 (1)
Stoich.:	A4B4C11D20 (1)
Weight, g/mol:	608.303893
ΔH_f, kcal/mol:	-135.87
Dipole, Da:	2.78
IP(EA), eV:	-9.71(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-naphthalen-2-yl-2-[(2R,5R)-3,4,5-tris(phenylmethoxy)-2-prop-2-enylpiperidin-1-yl]acetonitrile

Drug info:

PubChemData

Smile

CC1=CN(N=N1)CCN2CC(C([C@@H](C2CO)O)O)O

DOS

IR

Vibrations