Geometry & MOs

Info

ID:	23420
PubChem CID:	603448
Reduced:	NOC10H10 (2)
Stoich.:	ABC10D10 (2)
Weight, g/mol:	320.152478
ΔH_f, kcal/mol:	-10.24
Dipole, Da:	7.86
IP(EA), eV:	-8.52(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(1,3,3-trimethylindol-2-ylidene)ethylideneamino]benzoic acid

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2N(C1=CC=NC3=CC=C(C=C3)C(=O)O)C)C

DOS

IR

Vibrations