Geometry & MOs

Info

ID:	217074
PubChem CID:	85087206
Reduced:	OCl2N3H9C16 (1)
Stoich.:	AB2C3D9E16 (1)
Weight, g/mol:	330.128216
ΔH_f, kcal/mol:	57.62
Dipole, Da:	2.73
IP(EA), eV:	-9.04(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	2

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

C1=CC(=CC=C1N2C(=O)C3C=NC4=C(C3=N2)C=C(C=C4)Cl)Cl

DOS

IR

Vibrations