Geometry & MOs

Info

ID:	333783
PubChem CID:	127252335
Reduced:	ON3C14H23 (1)
Stoich.:	AB3C14D23 (1)
Weight, g/mol:	217.121512
ΔH_f, kcal/mol:	-29.86
Dipole, Da:	1.38
IP(EA), eV:	-8.56(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-(1H-pyrrolo[2,3-b]pyridin-2-yl)morpholine

Drug info:

PubChemData

Smile

C1CCC(C1)N2CCC(C2)C3=NNC(=C3)CCO

DOS

IR

Vibrations