Geometry & MOs

Info

ID:	121101
PubChem CID:	50755907
Reduced:	ClO2N3H14C17 (1)
Stoich.:	AB2C3D14E17 (1)
Weight, g/mol:	278.090272
ΔH_f, kcal/mol:	19.44
Dipole, Da:	6.42
IP(EA), eV:	-9.85(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5,6-dimethoxy-1H-indole-2-carbonyl)amino]acetic acid

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=NC(=NO2)CNC(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations