Geometry & MOs

Info

ID:	159179
PubChem CID:	57264327
Reduced:	NO3C9H15 (1)
Stoich.:	AB3C9D15 (1)
Weight, g/mol:	162.136828
ΔH_f, kcal/mol:	-83.11
Dipole, Da:	4.25
IP(EA), eV:	-9.54(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-diamino-2-ethyl-2-methylbutane-1,3-diol

Drug info:

PubChemData

Smile

CCONC=C1C(C1(C)C)C(=O)O

DOS

IR

Vibrations