Geometry & MOs

Info

ID:	48133
PubChem CID:	10537356
Reduced:	ClN2H3C4 (2)
Stoich.:	AB2C3D4 (2)
Weight, g/mol:	229.037508
ΔH_f, kcal/mol:	86.97
Dipole, Da:	7.28
IP(EA), eV:	-9.75(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(9-methyloxoniumylidene-7-oxofuro[3,2-g]chromen-4-ylidene)azanide

Drug info:

PubChemData

Smile

C=CCN1C=NC2=C1C(=NC(=N2)Cl)Cl

DOS

IR

Vibrations