Geometry & MOs

Info

ID:	306465
PubChem CID:	125011822
Reduced:	SO2N3C15H19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	475.187399
ΔH_f, kcal/mol:	-39.58
Dipole, Da:	9.08
IP(EA), eV:	-9.08(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3R)-3-[(3-chlorophenoxy)methyl]-1-(5-ethyl-1,2-oxazole-3-carbonyl)piperidin-3-yl]-1-morpholin-4-ylethanone

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CC[C@H](C2)C3=NC=C(N3)C

DOS

IR

Vibrations