Geometry & MOs

Info

ID:	49377
PubChem CID:	11532941
Reduced:	Cl2O2N3C25H27 (1)
Stoich.:	A2B2C3D25E27 (1)
Weight, g/mol:	472.115818
ΔH_f, kcal/mol:	-40.28
Dipole, Da:	2.07
IP(EA), eV:	-8.68(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[5-(7-oxofuro[3,2-g]chromen-4-yl)oxypentoxy]furo[3,2-g]chromen-7-one

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)Cl)N(CCCO)C3=C(C=CC=N3)Cl

DOS

IR

Vibrations