Geometry & MOs

Info

ID:	401800
PubChem CID:	135052661
Reduced:	BrSeN2C6H7 (1)
Stoich.:	ABC2D6E7 (1)
Weight, g/mol:	607.037097
ΔH_f, kcal/mol:	57.26
Dipole, Da:	5.64
IP(EA), eV:	-7.75(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-N-[(E)-2-chloro-2-(4-chlorophenyl)-1-[chloro(triphenyl)-lambda5-phosphanyl]ethenyl]benzenecarboximidoyl chloride

Drug info:

PubChemData

Smile

CC1=C[Se]C(=[NH+]1)CC#N.[Br-]

DOS

IR

Vibrations