Geometry & MOs

Info

ID:	240839
PubChem CID:	93617765
Reduced:	NO2C3H6 (2)
Stoich.:	AB2C3D6 (2)
Weight, g/mol:	188.116092
ΔH_f, kcal/mol:	-186.84
Dipole, Da:	5.46
IP(EA), eV:	-10.17(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R)-3-methyl-2-(methylcarbamoylamino)pentanoic acid

Drug info:

PubChemData

Smile

C[C@H]([C@H](C(=O)O)NC(=O)NC)O

DOS

IR

Vibrations