Geometry & MOs

Info

ID:	413477
PubChem CID:	135086426
Reduced:	SO2N4H16C21 (1)
Stoich.:	AB2C4D16E21 (1)
Weight, g/mol:	368.155849
ΔH_f, kcal/mol:	73.99
Dipole, Da:	3.49
IP(EA), eV:	-8.54(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-acetyl-1-hexylindol-2-yl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)/N=C\2/C(=[N+]=[N-])C3=CC=CC=C3N2C4=CC=CC=C4

DOS

IR

Vibrations