Geometry & MOs

Info

ID:	12056
PubChem CID:	128407
Reduced:	NO3C6H11 (2)
Stoich.:	AB3C6D11 (2)
Weight, g/mol:	290.147786
ΔH_f, kcal/mol:	-222.97
Dipole, Da:	3.85
IP(EA), eV:	-10.14(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-carboxy-4-hydroxy-2-methylheptan-3-yl)amino]-N-methoxy-2-oxoethanimine oxide

Drug info:

PubChemData

Smile

CCC(C(C(C(C)C)NC(=O)C=[N+]([O-])OC)O)C(=O)O

DOS

IR

Vibrations