Geometry & MOs

Info

ID:	341263
PubChem CID:	127263698
Reduced:	NO2C7H13 (1)
Stoich.:	AB2C7D13 (1)
Weight, g/mol:	123.045092
ΔH_f, kcal/mol:	-94.16
Dipole, Da:	4.75
IP(EA), eV:	-9.73(2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-aminobutan-2-one;hydrochloride

Drug info:

PubChemData

Smile

C1COC2C1C(CO2)CN

DOS

IR

Vibrations