Geometry & MOs

Info

ID:	220835
PubChem CID:	85240154
Reduced:	O2N3H11C16 (1)
Stoich.:	A2B3C11D16 (1)
Weight, g/mol:	277.085127
ΔH_f, kcal/mol:	61.02
Dipole, Da:	1.17
IP(EA), eV:	-8.3(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-hydroxyphenyl)-9aH-pyrazolo[3,4-c]quinolin-4-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=CN2)C3=COC(=N3)N=CC4=CC=CO4

DOS

IR

Vibrations