Geometry & MOs

Info

ID:	178856
PubChem CID:	76391320
Reduced:	ClN2O6C30H39 (1)
Stoich.:	AB2C6D30E39 (1)
Weight, g/mol:	353.88264
ΔH_f, kcal/mol:	-261.66
Dipole, Da:	5.12
IP(EA), eV:	-9.01(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dibromo-4H-phenazin-1-one

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1N(CC(C)(C)C)C(=O)CCC(=O)N2CCCC(C2)C(=O)O)C(C3=CC=CC=C3OC)O)Cl

DOS

IR

Vibrations