Geometry & MOs

Info

ID:	337976
PubChem CID:	127258599
Reduced:	NO6C9H15 (1)
Stoich.:	AB6C9D15 (1)
Weight, g/mol:	247.105587
ΔH_f, kcal/mol:	-248.6
Dipole, Da:	6.75
IP(EA), eV:	-10.94(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-carboxypropan-2-yl(methoxy)carbamoyl]butanoic acid

Drug info:

PubChemData

Smile

CCC(C(=O)N(C(C)CC(=O)O)O)C(=O)O

DOS

IR

Vibrations