Geometry & MOs

Info

ID:	136344
PubChem CID:	52026296
Reduced:	O3N5H15C16 (1)
Stoich.:	A3B5C15D16 (1)
Weight, g/mol:	289.121512
ΔH_f, kcal/mol:	-11.23
Dipole, Da:	5.65
IP(EA), eV:	-9.24(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyano-N-(2-indol-1-ylethyl)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=NC2=NN=C(N12)CNC(=O)C3=CC4=C(C=C3)OCO4)C

DOS

IR

Vibrations