Geometry & MOs

Info

ID:	307497
PubChem CID:	125307148
Reduced:	N2O2C19H22 (1)
Stoich.:	A2B2C19D22 (1)
Weight, g/mol:	346.062343
ΔH_f, kcal/mol:	3.29
Dipole, Da:	5.65
IP(EA), eV:	-8.56(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-3-[(4-methoxyphenyl)sulfonylamino]-2H-indole-2-carboxylic acid

Drug info:

PubChemData

Smile

CCOC1=C(C=CC=C1OC)[C@H](CN)C2=C3C=CC=CC3=NC2

DOS

IR

Vibrations