Geometry & MOs

Info

ID:	159173
PubChem CID:	57264299
Reduced:	N2O6C11H18 (1)
Stoich.:	A2B6C11D18 (1)
Weight, g/mol:	189.100108
ΔH_f, kcal/mol:	-256.11
Dipole, Da:	6.27
IP(EA), eV:	-10.48(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-amino-4-butoxy-4-oxobutanoic acid

Drug info:

PubChemData

Smile

CCOC(=O)C(C(=O)O)NC(=O)C(CC(C)C=N)O

DOS

IR

Vibrations