Geometry & MOs

Info

ID:	225577
PubChem CID:	85856234
Reduced:	N2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	512.173607
ΔH_f, kcal/mol:	-29.38
Dipole, Da:	1.62
IP(EA), eV:	-8.64(0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[4-(6-fluoren-9-ylidene-5-hydroxycyclohexa-2,4-dien-1-yl)-2-hydroxyphenyl]benzene-1,4-dicarboxamide

Drug info:

PubChemData

Smile

CC1=CC(N(N1C2=CC=CC=C2)C)C(=O)OC

DOS

IR

Vibrations