Geometry & MOs

Info

ID:	326323
PubChem CID:	126687330
Reduced:	ClO2C10H15 (1)
Stoich.:	AB2C10D15 (1)
Weight, g/mol:	201.136493
ΔH_f, kcal/mol:	-122.03
Dipole, Da:	5.65
IP(EA), eV:	-10.5(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-2-(1-hydroxyethyl)-5-methylcyclohexyl] carbamate

Drug info:

PubChemData

Smile

C[C@@H]1CC[C@@H]2[C@@H](C1)OC(=O)C2(C)Cl

DOS

IR

Vibrations