Geometry & MOs

Info

ID:	413612
PubChem CID:	135086561
Reduced:	N2O2C15H18 (1)
Stoich.:	A2B2C15D18 (1)
Weight, g/mol:	258.136828
ΔH_f, kcal/mol:	-25.92
Dipole, Da:	5.44
IP(EA), eV:	-8.51(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(5-methyl-1H-indol-3-yl)butan-2-ylideneamino] acetate

Drug info:

PubChemData

Smile

CC(CC(=NOC(=O)C)C)C1=CNC2=CC=CC=C21

DOS

IR

Vibrations