Geometry & MOs

Info

ID:	229366
PubChem CID:	87567487
Reduced:	NOCl2H9C14 (1)
Stoich.:	ABC2D9E14 (1)
Weight, g/mol:	213.052915
ΔH_f, kcal/mol:	24.87
Dipole, Da:	2.44
IP(EA), eV:	-9.5(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC(=NC(=C1)Cl)C(=O)/C=C/C2=CC=C(C=C2)Cl

DOS

IR

Vibrations