Geometry & MOs

Info

ID:	418810
PubChem CID:	135106842
Reduced:	O2N3C19H23 (1)
Stoich.:	A2B3C19D23 (1)
Weight, g/mol:	365.150619
ΔH_f, kcal/mol:	-39.5
Dipole, Da:	3.66
IP(EA), eV:	-9.69(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5R,6S)-5-(2-chlorophenyl)-6-[4-(methylaminomethyl)piperidine-1-carbonyl]morpholin-3-one

Drug info:

PubChemData

Smile

C1[C@H]([C@H](CO1)NC(=O)C2=CC=C(C=C2)CCN)CC3=CC=NC=C3

DOS

IR

Vibrations