Geometry & MOs

Info

ID:	337405
PubChem CID:	127257090
Reduced:	NSO2C9H9 (1)
Stoich.:	ABC2D9E9 (1)
Weight, g/mol:	252.118401
ΔH_f, kcal/mol:	-33.78
Dipole, Da:	2.6
IP(EA), eV:	-9.23(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclohexylethyl 2-thiophen-3-ylacetate

Drug info:

PubChemData

Smile

CC(C#N)OC(=O)CC1=CSC=C1

DOS

IR

Vibrations