Geometry & MOs

Info

ID:	302989
PubChem CID:	124489071
Reduced:	NO2C9H19 (1)
Stoich.:	AB2C9D19 (1)
Weight, g/mol:	173.141579
ΔH_f, kcal/mol:	-114.86
Dipole, Da:	3.55
IP(EA), eV:	-9.65(1.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-2-[(1R,3R)-3-methoxycyclohexyl]ethanol

Drug info:

PubChemData

Smile

CO[C@@H]1CCC[C@@H](C1)[C@@H](CO)N

DOS

IR

Vibrations