Geometry & MOs

Info

ID:	15193
PubChem CID:	432905
Reduced:	SN2O2C20H24 (1)
Stoich.:	AB2C2D20E24 (1)
Weight, g/mol:	356.155849
ΔH_f, kcal/mol:	-50.81
Dipole, Da:	3.2
IP(EA), eV:	-8.02(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(diethylamino)ethylamino]-7-hydroxy-4-methylthioxanthen-9-one

Drug info:

PubChemData

Smile

CCN(CC)CCNC1=C2C(=C(C=C1)C)SC3=C(C2=O)C=C(C=C3)O

DOS

IR

Vibrations