Geometry & MOs

Info

ID:	81743
PubChem CID:	49855079
Reduced:	ON2H18C19 (1)
Stoich.:	AB2C18D19 (1)
Weight, g/mol:	370.12772
ΔH_f, kcal/mol:	34.44
Dipole, Da:	3.22
IP(EA), eV:	-7.99(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4Z)-4-[4-(3-hydroxy-4-methoxyphenyl)-1,2-dihydropyrazol-3-ylidene]-3-oxocyclohexa-1,5-dien-1-yl]oxyacetohydrazide

Drug info:

PubChemData

Smile

CN1CCC2=C(C1)C3=C4N2C5=CC=CC=C5COC4=CC=C3

DOS

IR

Vibrations