Geometry & MOs

Info

ID:	425724
PubChem CID:	135127611
Reduced:	NO2H19C21 (1)
Stoich.:	AB2C19D21 (1)
Weight, g/mol:	448.074533
ΔH_f, kcal/mol:	-4.77
Dipole, Da:	3.48
IP(EA), eV:	-8.0(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,8-bis(2-chloroanilino)-1,2-dihydrobenzo[c]chromen-6-one

Drug info:

PubChemData

Smile

C/C=C\C1=C(C2=CC=CC=C2N1)/C=C/C3=CC=CC=C3C(=O)OC

DOS

IR

Vibrations