Geometry & MOs

Info

ID:	198975
PubChem CID:	79182097
Reduced:	N2O3C14H24 (1)
Stoich.:	A2B3C14D24 (1)
Weight, g/mol:	282.194343
ΔH_f, kcal/mol:	-133.45
Dipole, Da:	7.51
IP(EA), eV:	-8.83(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-methylmorpholin-2-yl)methyl]-2,3,3a,4,5,6,7,7a-octahydroindole-2-carboxylic acid

Drug info:

PubChemData

Smile

CCN1CCOC(C1)CN2C3CCC2C(C3)C(=O)O

DOS

IR

Vibrations