Geometry & MOs

Info

ID:	14574
PubChem CID:	415165
Reduced:	OS2N4C20H20 (1)
Stoich.:	AB2C4D20E20 (1)
Weight, g/mol:	396.107854
ΔH_f, kcal/mol:	71.42
Dipole, Da:	4.84
IP(EA), eV:	-8.81(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(carbamimidoylsulfanylmethyl)-2,5-diphenylfuran-3-yl]methyl carbamimidothioate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(C(=C(O2)C3=CC=CC=C3)CSC(=N)N)CSC(=N)N

DOS

IR

Vibrations