Geometry & MOs

Info

ID:	389673
PubChem CID:	134994408
Reduced:	NO3C15H23 (1)
Stoich.:	AB3C15D23 (1)
Weight, g/mol:	229.032813
ΔH_f, kcal/mol:	-110.63
Dipole, Da:	4.92
IP(EA), eV:	-9.74(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-chloro-2-nitrosocyclohexyl)thiophene

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)ONC(C)(C(=O)O)C(C)(C)C

DOS

IR

Vibrations