Geometry & MOs

Info

ID:	234511
PubChem CID:	92298581
Reduced:	NO8C19H19 (1)
Stoich.:	AB8C19D19 (1)
Weight, g/mol:	349.978046
ΔH_f, kcal/mol:	-304.91
Dipole, Da:	6.1
IP(EA), eV:	-9.57(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-(2-chlorophenyl)-2-cyano-N-(2,6-dichlorophenyl)prop-2-enamide

Drug info:

PubChemData

Smile

C1CC2=C(C1)C(=O)OC3=C2C=CC(=C3)OCC(=O)N[C@H](CCC(=O)O)C(=O)O

DOS

IR

Vibrations