Geometry & MOs

Info

ID:	240960
PubChem CID:	93618434
Reduced:	O2N3C14H21 (1)
Stoich.:	A2B3C14D21 (1)
Weight, g/mol:	299.163377
ΔH_f, kcal/mol:	-63.85
Dipole, Da:	2.73
IP(EA), eV:	-8.75(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,6R)-2,6-dimethylmorpholin-4-yl]-[4-(imidazol-1-ylmethyl)phenyl]methanone

Drug info:

PubChemData

Smile

C[C@@H]1CN(C[C@@H](O1)C)C(=O)C2=CC(=NC=C2)N(C)C

DOS

IR

Vibrations