Geometry & MOs

Info

ID:	84511
PubChem CID:	49867103
Reduced:	ON2C3H4 (3)
Stoich.:	AB2C3D4 (3)
Weight, g/mol:	395.047643
ΔH_f, kcal/mol:	-64.79
Dipole, Da:	13.47
IP(EA), eV:	-9.09(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=NC2=C(N1CC[C@@H](C(=O)O)N)NC(=NC2=O)N

DOS

IR

Vibrations