Geometry & MOs

Info

ID:	169178
PubChem CID:	75070461
Reduced:	N3C4O4H7 (1)
Stoich.:	A3B4C4D7 (1)
Weight, g/mol:	559.03107
ΔH_f, kcal/mol:	4.42
Dipole, Da:	1.76
IP(EA), eV:	-9.68(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C(C1C(=CN=O)NO[NH+]1[O-])O

DOS

IR

Vibrations