Geometry & MOs

Info

ID:	162395
PubChem CID:	57394542
Reduced:	F2O2H12C15 (1)
Stoich.:	A2B2C12D15 (1)
Weight, g/mol:	394.262028
ΔH_f, kcal/mol:	-140.02
Dipole, Da:	1.14
IP(EA), eV:	-9.48(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-dodecoxy-1-phenyl-2H-pyrrolo[3,4-c]pyridin-3-one

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CCC(=O)C2=C(C=CC(=C2)F)O)F

DOS

IR

Vibrations