Geometry & MOs

Info

ID:	39050
PubChem CID:	8138505
Reduced:	SN3O4H19C21 (1)
Stoich.:	AB3C4D19E21 (1)
Weight, g/mol:	268.096026
ΔH_f, kcal/mol:	-51.89
Dipole, Da:	5.43
IP(EA), eV:	-8.97(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(1H-pyrrole-2-carbonyl)-1H-indole-2-carbohydrazide

Drug info:

PubChemData

Smile

C[C@@H](C1=NC2=CC=CC=C2S1)N(C)C(=O)COC(=O)COC3=CC=CC=C3C#N

DOS

IR

Vibrations