Geometry & MOs

Info

ID:	27938
PubChem CID:	824205
Reduced:	BrON2H15C17 (1)
Stoich.:	ABC2D15E17 (1)
Weight, g/mol:	289.01023
ΔH_f, kcal/mol:	38.38
Dipole, Da:	10.91
IP(EA), eV:	-8.43(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-bromo-4-methylphenyl)iminomethyl]phenol

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC2=C3C=C(C(=CC3=NC2=O)Br)C)C

DOS

IR

Vibrations