Geometry & MOs

Info

ID:	189615
PubChem CID:	77881842
Reduced:	N3O4C10H15 (1)
Stoich.:	A3B4C10D15 (1)
Weight, g/mol:	417.282497
ΔH_f, kcal/mol:	-151.72
Dipole, Da:	4.25
IP(EA), eV:	-10.31(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(CC1=CC(=NC=C1)C(=O)O)(C(=O)O)N.N

DOS

IR

Vibrations