Geometry & MOs

Info

ID:	19129
PubChem CID:	555155
Reduced:	BrON3H22C23 (1)
Stoich.:	ABC3D22E23 (1)
Weight, g/mol:	435.09462
ΔH_f, kcal/mol:	75.26
Dipole, Da:	1.24
IP(EA), eV:	-8.89(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-tert-butyl-6-[(4-phenyldiazenylphenyl)iminomethyl]phenol

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=CC(=C1O)C=NC2=CC=C(C=C2)N=NC3=CC=CC=C3)Br

DOS

IR

Vibrations