Geometry & MOs

Info

ID:	307666
PubChem CID:	125307954
Reduced:	NO9C25H27 (1)
Stoich.:	AB9C25D27 (1)
Weight, g/mol:	259.132077
ΔH_f, kcal/mol:	-331.92
Dipole, Da:	4.19
IP(EA), eV:	-8.79(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-2-(2H-indol-3-yl)-2-oxoacetamide

Drug info:

PubChemData

Smile

C[C@@H]1[C@H]([C@H]([C@@H](CO1)O[C@H]2C[C@H](CC3=C2C(=C4C(=C3O)C(=O)C5=C(C4=O)C(=CC=C5)OC)O)O)N)O

DOS

IR

Vibrations