Geometry & MOs

Info

ID:	30478
PubChem CID:	841394
Reduced:	BrO3N4H7C10 (1)
Stoich.:	AB3C4D7E10 (1)
Weight, g/mol:	345.147727
ΔH_f, kcal/mol:	25.79
Dipole, Da:	1.81
IP(EA), eV:	-9.38(-2.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(anilinomethyl)-N-[(4-hydroxyphenyl)methylideneamino]benzamide

Drug info:

PubChemData

Smile

C1=CC(=CC=C1NC(=O)C2=C(C=NN2)[N+](=O)[O-])Br

DOS

IR

Vibrations