Geometry & MOs

Info

ID:	387742
PubChem CID:	134986681
Reduced:	NO3C10H13 (1)
Stoich.:	AB3C10D13 (1)
Weight, g/mol:	227.998781
ΔH_f, kcal/mol:	-28.44
Dipole, Da:	2.92
IP(EA), eV:	-9.27(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-4,4,4-trichloro-N-(propan-2-ylideneamino)butan-2-imine

Drug info:

PubChemData

Smile

COC1=CC2=NCC2=CC1(OC)OC

DOS

IR

Vibrations