Geometry & MOs

Info

ID:	163326
PubChem CID:	57747049
Reduced:	N2O6C15H20 (1)
Stoich.:	A2B6C15D20 (1)
Weight, g/mol:	240.136159
ΔH_f, kcal/mol:	-171.84
Dipole, Da:	6.44
IP(EA), eV:	-9.98(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(1-methylcyclohexyl)oxy-2-oxoethyl] 2-methylprop-2-enoate

Drug info:

PubChemData

Smile

CCOC(=O)[C@H](C)N[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OC

DOS

IR

Vibrations