Geometry & MOs

Info

ID:	38823
PubChem CID:	8137986
Reduced:	Cl2O2N3H11C14 (1)
Stoich.:	A2B2C3D11E14 (1)
Weight, g/mol:	354.98177
ΔH_f, kcal/mol:	-14.54
Dipole, Da:	1.54
IP(EA), eV:	-9.39(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(3-iodobenzoyl)-1H-pyrrole-2-carbohydrazide

Drug info:

PubChemData

Smile

C1=CNC(=C1)C(=O)NNC(=O)/C=C/C2=C(C=C(C=C2)Cl)Cl

DOS

IR

Vibrations