Geometry & MOs

Info

ID:	408332
PubChem CID:	135081098
Reduced:	NOSC14H17 (1)
Stoich.:	ABCD14E17 (1)
Weight, g/mol:	182.057909
ΔH_f, kcal/mol:	33.78
Dipole, Da:	3.09
IP(EA), eV:	-8.14(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(furan-2-yl)-3-methoxyprop-2-enoate

Drug info:

PubChemData

Smile

CC1(C(=O)C(C1=S=NC2=CC=CC=C2)(C)C)C

DOS

IR

Vibrations