Geometry & MOs

Info

ID:	85434
PubChem CID:	49875066
Reduced:	ClSN2O3H5C6 (1)
Stoich.:	ABC2D3E5F6 (1)
Weight, g/mol:	564.101638
ΔH_f, kcal/mol:	15.48
Dipole, Da:	4.79
IP(EA), eV:	-9.82(-1.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethoxycarbonyloxyethyl 2-butyl-5-chloro-3-[[5-[2-(2H-tetrazol-5-yl)thiophen-3-yl]thiophen-2-yl]methyl]imidazole-4-carboxylate

Drug info:

PubChemData

Smile

C/C(=N/O)/C1=C(SC(=C1)[N+](=O)[O-])Cl

DOS

IR

Vibrations