Geometry & MOs

Info

ID:	407303
PubChem CID:	135079768
Reduced:	ClON2S2H11C17 (1)
Stoich.:	ABC2D2E11F17 (1)
Weight, g/mol:	309.971898
ΔH_f, kcal/mol:	87.19
Dipole, Da:	3.06
IP(EA), eV:	-8.99(-1.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-chloro-2,3-bis(4-chlorophenyl)prop-2-enal

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)/C=C(\C(=O)C2=CC=CC=C2)/N=C3C(=NSS3)Cl

DOS

IR

Vibrations