Geometry & MOs

Info

ID:	85630
PubChem CID:	49877781
Reduced:	O2N3H17C19 (1)
Stoich.:	A2B3C17D19 (1)
Weight, g/mol:	278.116761
ΔH_f, kcal/mol:	48.37
Dipole, Da:	6.92
IP(EA), eV:	-8.69(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N'-[(E)-indol-3-ylidenemethyl]benzohydrazide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(=O)NN/C=C/C=C\2/C=NC3=CC=CC=C32

DOS

IR

Vibrations