Geometry & MOs

Info

ID:	139453
PubChem CID:	52533168
Reduced:	ClN2O5C17H27 (1)
Stoich.:	AB2C5D17E27 (1)
Weight, g/mol:	347.163377
ΔH_f, kcal/mol:	-212.68
Dipole, Da:	8.05
IP(EA), eV:	-8.6(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S,6R)-2-methyl-6-phenylmorpholin-4-yl]-(3-phenylimidazol-4-yl)methanone

Drug info:

PubChemData

Smile

CC(C)OCCOC[C@@H](CN(C)C(=O)NC1=C(C=CC(=C1)Cl)OC)O

DOS

IR

Vibrations