Geometry & MOs

Info

ID:	340368
PubChem CID:	127262379
Reduced:	NO3C11H19 (1)
Stoich.:	AB3C11D19 (1)
Weight, g/mol:	213.136493
ΔH_f, kcal/mol:	-156.98
Dipole, Da:	4.82
IP(EA), eV:	-9.25(1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1R,3R)-3-(dimethylcarbamoyl)cyclohexyl] acetate

Drug info:

PubChemData

Smile

CC(=O)O[C@H]1CCC[C@H](C1)C(=O)N(C)C

DOS

IR

Vibrations