Geometry & MOs

Info

ID:	387371
PubChem CID:	134985121
Reduced:	NO6C23H23 (1)
Stoich.:	AB6C23D23 (1)
Weight, g/mol:	310.027583
ΔH_f, kcal/mol:	-127.41
Dipole, Da:	6.74
IP(EA), eV:	-9.21(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[chloro(phenyl)methyl]-[[chloro(phenyl)methyl]-oxidoamino]-oxoazanium

Drug info:

PubChemData

Smile

CCOC(=O)/C(=C(/CCCN=O)\C(=O)OCC1=CC=CC=C1)/C(=O)C2=CC=CC=C2

DOS

IR

Vibrations