Geometry & MOs

Info

ID:	231305
PubChem CID:	87573433
Reduced:	O3N5C11H11 (1)
Stoich.:	A3B5C11D11 (1)
Weight, g/mol:	280.191678
ΔH_f, kcal/mol:	-27.88
Dipole, Da:	2.96
IP(EA), eV:	-9.83(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CC(=O)C1=CC(=NC=C1)CN2N=CC(=N2)NC(=O)O

DOS

IR

Vibrations