Geometry & MOs

Info

ID:	58217
PubChem CID:	24434793
Reduced:	N3C10H11 (2)
Stoich.:	A3B10C11 (2)
Weight, g/mol:	243.100777
ΔH_f, kcal/mol:	129.61
Dipole, Da:	3.31
IP(EA), eV:	-8.37(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6Z)-4-hydroxy-6-[1-(2-pyridin-2-ylhydrazinyl)ethylidene]cyclohexa-2,4-dien-1-one

Drug info:

PubChemData

Smile

CC1=NN(C(=C1/C=N/NC2=CC=CC=N2)N3CCCC3)C4=CC=CC=C4

DOS

IR

Vibrations