Geometry & MOs

Info

ID:	33928
PubChem CID:	7888840
Reduced:	N2O3H18C19 (1)
Stoich.:	A2B3C18D19 (1)
Weight, g/mol:	354.121572
ΔH_f, kcal/mol:	-77.22
Dipole, Da:	6.96
IP(EA), eV:	-8.57(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,5-dimethoxyanilino)-2-oxoethyl] 1H-indole-3-carboxylate

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)NC(=O)COC(=O)C2=CNC3=CC=CC=C32)C

DOS

IR

Vibrations