Geometry & MOs

Info

ID:	189613
PubChem CID:	77881502
Reduced:	N4O5S5C16H16 (1)
Stoich.:	A4B5C5D16E16 (1)
Weight, g/mol:	438.886359
ΔH_f, kcal/mol:	-78.9
Dipole, Da:	7.16
IP(EA), eV:	-9.2(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=O)N(C1C2N(C1=O)CC(CS2)(CSC3=NC=NS3)C(=O)O)S(=O)C4=CC=CS4

DOS

IR

Vibrations