Geometry & MOs

Info

ID:	21221
PubChem CID:	587710
Reduced:	ClN3O3C18H20 (1)
Stoich.:	AB3C3D18E20 (1)
Weight, g/mol:	361.119319
ΔH_f, kcal/mol:	-68.43
Dipole, Da:	3.68
IP(EA), eV:	-9.68(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N'-(2-ethyl-2-hydroxybutanoyl)-N-phenylpyridine-3-carbohydrazide

Drug info:

PubChemData

Smile

CCC(CC)(C(=O)NN(C1=CC=CC=C1)C(=O)C2=C(N=CC=C2)Cl)O

DOS

IR

Vibrations