Geometry & MOs

Info

ID:	66125
PubChem CID:	46499883
Reduced:	FO3N4H21C25 (1)
Stoich.:	AB3C4D21E25 (1)
Weight, g/mol:	350.13789
ΔH_f, kcal/mol:	-28.61
Dipole, Da:	5.3
IP(EA), eV:	-8.15(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-benzodioxol-5-ylamino)-N'-[(E)-(2-methylindol-3-ylidene)methyl]acetohydrazide

Drug info:

PubChemData

Smile

C1OC2=C(O1)C=C(C=C2)NCC(=O)N/N=C\C3=CN(C4=CC=CC=C43)CC5=CC=C(C=C5)F

DOS

IR

Vibrations