Geometry & MOs

Info

ID:	338556
PubChem CID:	127259567
Reduced:	ON2C9H12 (1)
Stoich.:	AB2C9D12 (1)
Weight, g/mol:	314.058883
ΔH_f, kcal/mol:	-11.08
Dipole, Da:	3.74
IP(EA), eV:	-9.0(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(Z)-[1-(3,4-dichlorophenyl)-4-ethoxybutylidene]amino]oxyacetonitrile

Drug info:

PubChemData

Smile

C1CCC(=O)/C(=C\NCC#N)/C1

DOS

IR

Vibrations