Geometry & MOs

Info

ID:	16209
PubChem CID:	461602
Reduced:	ClNSO4C16H16 (1)
Stoich.:	ABCD4E16F16 (1)
Weight, g/mol:	353.048857
ΔH_f, kcal/mol:	-119.49
Dipole, Da:	2.97
IP(EA), eV:	-8.93(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chloro-3-propan-2-yloxycarbonyloxyphenyl)-2-methylfuran-3-carboximidothioic acid

Drug info:

PubChemData

Smile

CC1=C(C=CO1)C(=NC2=CC(=C(C=C2)Cl)OC(=O)OC(C)C)S

DOS

IR

Vibrations