Geometry & MOs

Info

ID:	196874
PubChem CID:	78889151
Reduced:	BrO4H13C14 (1)
Stoich.:	AB4C13D14 (1)
Weight, g/mol:	334.142976
ΔH_f, kcal/mol:	-100.71
Dipole, Da:	1.68
IP(EA), eV:	-8.62(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(4-ethylbenzoyl)-2-pyrazol-1-ylbenzohydrazide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC(=O)C2=C(C=C(O2)Br)C)OC

DOS

IR

Vibrations