Geometry & MOs

Info

ID:	406934
PubChem CID:	135078951
Reduced:	NOCl3C6H6 (1)
Stoich.:	ABC3D6E6 (1)
Weight, g/mol:	385.0062
ΔH_f, kcal/mol:	-73.85
Dipole, Da:	2.18
IP(EA), eV:	-9.73(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1Z)-2-anilino-N-[2-(4-bromophenyl)-2-oxoethoxy]-2-oxoethanimidoyl cyanide

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1O)N)Cl)Cl.Cl

DOS

IR

Vibrations