Geometry & MOs

Info

ID:	305741
PubChem CID:	124967343
Reduced:	O2N3C17H27 (1)
Stoich.:	A2B3C17D27 (1)
Weight, g/mol:	454.238706
ΔH_f, kcal/mol:	-110.35
Dipole, Da:	7.72
IP(EA), eV:	-9.22(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-[(3R)-3-[(4-chloro-3-methylphenoxy)methyl]-1-(cyclopropylmethyl)piperidin-3-yl]-N-methylacetamide

Drug info:

PubChemData

Smile

CC1=CN=C(N1)[C@@H]2CCCN(C2)C(=O)CC3(CCCCC3)O

DOS

IR

Vibrations