Geometry & MOs

Info

ID:	227246
PubChem CID:	87560831
Reduced:	NOC5H7 (2)
Stoich.:	ABC5D7 (2)
Weight, g/mol:	304.106896
ΔH_f, kcal/mol:	-26.5
Dipole, Da:	3.71
IP(EA), eV:	-9.2(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2S)-5-(diaminomethylideneamino)-2-(methoxyamino)pentanoate;dihydrochloride

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C[C@H](CN(C=O)O)N

DOS

IR

Vibrations