Geometry & MOs

Info

ID:	413077
PubChem CID:	135086021
Reduced:	ClNSO2H12C15 (1)
Stoich.:	ABCD2E12F15 (1)
Weight, g/mol:	369.132471
ΔH_f, kcal/mol:	13.13
Dipole, Da:	6.39
IP(EA), eV:	-8.58(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(5,6-dimethoxy-1H-indol-3-yl)ethyl]-2-nitrobenzamide

Drug info:

PubChemData

Smile

CS(=O)(=O)N(C#CC1=CC=C(C=C1)Cl)C2=CC=CC=C2

DOS

IR

Vibrations