Geometry & MOs

Info

ID:	413249
PubChem CID:	135086196
Reduced:	NSO3H11C17 (1)
Stoich.:	ABC3D11E17 (1)
Weight, g/mol:	282.07712
ΔH_f, kcal/mol:	22.94
Dipole, Da:	4.18
IP(EA), eV:	-8.86(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(2,2-dimethoxyethyl)-1H-indole-2-carboxamide

Drug info:

PubChemData

Smile

C#CC1=C(N(C2=CC=CC=C21)S(=O)(=O)C3=CC=CC=C3)C=O

DOS

IR

Vibrations