Geometry & MOs

Info

ID:	184292
PubChem CID:	77140590
Reduced:	N4O5C11H14 (1)
Stoich.:	A4B5C11D14 (1)
Weight, g/mol:	558.175119
ΔH_f, kcal/mol:	-141.62
Dipole, Da:	2.36
IP(EA), eV:	-10.14(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C=C=CC1(C(C(OC1N2C=NC(=NC2=O)N)CO)O)O

DOS

IR

Vibrations