Geometry & MOs

Info

ID:	211995
PubChem CID:	81059122
Reduced:	FNO2C13H18 (1)
Stoich.:	ABC2D13E18 (1)
Weight, g/mol:	254.199428
ΔH_f, kcal/mol:	-123.83
Dipole, Da:	4.09
IP(EA), eV:	-9.37(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-ethoxyethyl)-N-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

CCOCCN(C)C(=O)C1=CC(=C(C=C1)F)C

DOS

IR

Vibrations