Geometry & MOs

Info

ID:	340373
PubChem CID:	127262384
Reduced:	NO3C9H15 (1)
Stoich.:	AB3C9D15 (1)
Weight, g/mol:	198.125594
ΔH_f, kcal/mol:	-115.79
Dipole, Da:	2.01
IP(EA), eV:	-9.88(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-1-oxopropan-2-yl) cyclohexanecarboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C\1CCCC/C1=N/O

DOS

IR

Vibrations