Geometry & MOs

Info

ID:	296234
PubChem CID:	117562122
Reduced:	ON3H15C16 (1)
Stoich.:	AB3C15D16 (1)
Weight, g/mol:	232.121178
ΔH_f, kcal/mol:	28.77
Dipole, Da:	9.08
IP(EA), eV:	-8.29(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylpropylamino)-1H-indole-3-carboxylic acid

Drug info:

PubChemData

Smile

CC(=O)C1=C(NC2=CC=CC=C21)NCC3=CC=CC=N3

DOS

IR

Vibrations