Geometry & MOs

Info

ID:	7822
PubChem CID:	74281
Reduced:	NO2H7C9 (1)
Stoich.:	AB2C7D9 (1)
Weight, g/mol:	161.047678
ΔH_f, kcal/mol:	-42.61
Dipole, Da:	4.54
IP(EA), eV:	-9.24(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1H-indole-7-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC2=C(C(=C1)C(=O)O)NC=C2

DOS

IR

Vibrations