Geometry & MOs

Info

ID:	69116
PubChem CID:	46519008
Reduced:	S2O3N4C16H26 (1)
Stoich.:	A2B3C4D16E26 (1)
Weight, g/mol:	300.147393
ΔH_f, kcal/mol:	-118.32
Dipole, Da:	3.5
IP(EA), eV:	-9.37(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[ethyl(2-methylprop-2-enyl)amino]-2-oxoethyl] 1H-indole-3-carboxylate

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCS(=O)(=O)C1)SC2=NNC(=N2)CCC3CCCC3

DOS

IR

Vibrations