Geometry & MOs

Info

ID:	47934
PubChem CID:	10535889
Reduced:	NOC5H8 (2)
Stoich.:	ABC5D8 (2)
Weight, g/mol:	196.055801
ΔH_f, kcal/mol:	-35.6
Dipole, Da:	1.06
IP(EA), eV:	-8.94(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-(furan-2-yl) 4-methylpent-3-enethioate

Drug info:

PubChemData

Smile

CCOC1=NOC2=C1C(CCC2)NC

DOS

IR

Vibrations