Geometry & MOs

Info

ID:	150592
PubChem CID:	53790285
Reduced:	O5C11H20 (1)
Stoich.:	A5B11C20 (1)
Weight, g/mol:	190.074228
ΔH_f, kcal/mol:	-250.21
Dipole, Da:	1.76
IP(EA), eV:	-10.11(1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-7-hydroxycinnolin-4-one

Drug info:

PubChemData

Smile

CC1(OC[C@@H](O1)C2[C@H](OC(O2)(C)C)CO)C

DOS

IR

Vibrations