Geometry & MOs

Info

ID:	46275
PubChem CID:	10523657
Reduced:	N3S3H11C19 (1)
Stoich.:	A3B3C11D19 (1)
Weight, g/mol:	377.89253
ΔH_f, kcal/mol:	142.44
Dipole, Da:	3.64
IP(EA), eV:	-8.48(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dibromo-2-(3,4-dimethoxyphenyl)-2H-furan-5-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SC4=NC5=CC=CC=C5S4

DOS

IR

Vibrations