Geometry & MOs

Info

ID:	19587
PubChem CID:	568450
Reduced:	BrN2H9C14 (1)
Stoich.:	AB2C9D14 (1)
Weight, g/mol:	283.99491
ΔH_f, kcal/mol:	107.42
Dipole, Da:	5.38
IP(EA), eV:	-9.59(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-bromophenyl)methylideneamino]benzonitrile

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C#N)N=CC2=CC=C(C=C2)Br

DOS

IR

Vibrations