Geometry & MOs

Info

ID:	403179
PubChem CID:	135059073
Reduced:	FNO2C12H14 (1)
Stoich.:	ABC2D12E14 (1)
Weight, g/mol:	180.097272
ΔH_f, kcal/mol:	-100.3
Dipole, Da:	0.84
IP(EA), eV:	-9.98(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-hex-3-en-3-yl]-5-methylthiophene

Drug info:

PubChemData

Smile

CCCCOC(=O)/C=C/C1=NC=C(C=C1)F

DOS

IR

Vibrations