Geometry & MOs

Info

ID:	35181
PubChem CID:	7979436
Reduced:	SN2O4C22H22 (1)
Stoich.:	AB2C4D22E22 (1)
Weight, g/mol:	404.150285
ΔH_f, kcal/mol:	-126.5
Dipole, Da:	4.87
IP(EA), eV:	-8.79(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)acetyl]-4-ethoxybenzohydrazide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)COC(=O)[C@@H]2CS[C@]3(N2C(=O)CC3)C4=CC=CC=C4

DOS

IR

Vibrations