Geometry & MOs

Info

ID:	31010
PubChem CID:	854089
Reduced:	ClN2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	232.121178
ΔH_f, kcal/mol:	14.74
Dipole, Da:	2.56
IP(EA), eV:	-8.57(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(dimethylamino)ethyl]indole-2-carboxylic acid

Drug info:

PubChemData

Smile

C[C@@H](CC1=CNC2=C1C=C(C=C2)Cl)N

DOS

IR

Vibrations