Geometry & MOs

Info

ID:	12574
PubChem CID:	140677
Reduced:	NO2H11C13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	213.078979
ΔH_f, kcal/mol:	22.84
Dipole, Da:	4.18
IP(EA), eV:	-8.83(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[(N-hydroxyanilino)methylidene]cyclohexa-2,4-dien-1-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)N(C=C2C=CC=CC2=O)O

DOS

IR

Vibrations