Geometry & MOs

Info

ID:	437190
PubChem CID:	135215637
Reduced:	OCl2N5C23H29 (1)
Stoich.:	AB2C5D23E29 (1)
Weight, g/mol:	381.151098
ΔH_f, kcal/mol:	7.0
Dipole, Da:	7.59
IP(EA), eV:	-9.04(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[2-(3-ethyl-1H-indol-5-yl)ethyl]-1H-indol-5-yl]methanesulfonamide

Drug info:

PubChemData

Smile

CC(C)N1C(=CC(=N1)C(C)CCC(C)N2C=NC3=CC(=C(C=C32)Cl)Cl)C(=O)NC4CC4

DOS

IR

Vibrations