Geometry & MOs

Info

ID:	296236
PubChem CID:	117562152
Reduced:	N2O2C13H14 (1)
Stoich.:	A2B2C13D14 (1)
Weight, g/mol:	261.147727
ΔH_f, kcal/mol:	-50.84
Dipole, Da:	8.25
IP(EA), eV:	-8.54(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(dimethylamino)propylamino]-1H-indole-3-carboxylic acid

Drug info:

PubChemData

Smile

C1CCN(C1)C2=C(C3=CC=CC=C3N2)C(=O)O

DOS

IR

Vibrations