Geometry & MOs

Info

ID:	82589
PubChem CID:	49856216
Reduced:	N2O3C6H15 (1)
Stoich.:	A2B3C6D15 (1)
Weight, g/mol:	335.149738
ΔH_f, kcal/mol:	-135.62
Dipole, Da:	7.75
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.754727
Charge, e:	0

Chem-info

IUPAC name:

sodium;2-[[4-(1-adamantyl)benzoyl]amino]acetate

Drug info:

PubChemData

Smile

C(CCN)C[C@@H](C(=O)O)N.[OH-]

DOS

IR

Vibrations