Geometry & MOs

Info

ID:	59231
PubChem CID:	24775798
Reduced:	SN2O2H10C15 (1)
Stoich.:	AB2C2D10E15 (1)
Weight, g/mol:	594.226705
ΔH_f, kcal/mol:	-1.81
Dipole, Da:	4.49
IP(EA), eV:	-8.32(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[[9-(ethylamino)-10-methylbenzo[a]phenoxazin-5-ylidene]amino]propyl]-9,10-dioxoanthracene-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C3=C(S2)C(=O)N4C=CC=CC4=N3

DOS

IR

Vibrations