Geometry & MOs

Info

ID:	146088
PubChem CID:	53633710
Reduced:	NOSC2H3 (2)
Stoich.:	ABCD2E3 (2)
Weight, g/mol:	344.162685
ΔH_f, kcal/mol:	-25.58
Dipole, Da:	4.32
IP(EA), eV:	-9.17(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[3-(5-diethoxyphosphorylfuran-2-yl)-3-oxoprop-1-enyl]-dimethyl-propan-2-ylazanium

Drug info:

PubChemData

Smile

C1C(=NOC(=O)N)SCS1

DOS

IR

Vibrations