Geometry & MOs

Info

ID:	7715
PubChem CID:	73803
Reduced:	ClN3O4C17H18 (1)
Stoich.:	AB3C4D17E18 (1)
Weight, g/mol:	363.098584
ΔH_f, kcal/mol:	-95.76
Dipole, Da:	5.91
IP(EA), eV:	-7.96(-2.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[7-(diethylamino)-3,4-dioxo-10H-phenoxazin-1-yl]-hydroxymethylidene]azanium;chloride

Drug info:

PubChemData

Smile

CCN(CC)C1=CC2=C(C=C1)NC3=C(O2)C(=O)C(=O)C=C3C(=[NH2+])O.[Cl-]

DOS

IR

Vibrations