Geometry & MOs

Info

ID:	31981
PubChem CID:	3726979
Reduced:	O3N6C27H28 (1)
Stoich.:	A3B6C27D28 (1)
Weight, g/mol:	396.010219
ΔH_f, kcal/mol:	0.22
Dipole, Da:	7.84
IP(EA), eV:	-9.03(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dichlorophenyl)-3-formyl-N,N-dimethyl-1H-indole-5-sulfonamide

Drug info:

PubChemData

Smile

CC1=NC(=C(C=C1)C(=O)NC2=CC=C(C=C2)N3C=CN=C3)C4CCN(CC4)C(=O)CC5=CC(=NO5)C

DOS

IR

Vibrations