Geometry & MOs

Info

ID:	28459
PubChem CID:	827736
Reduced:	ON2C19H20 (1)
Stoich.:	AB2C19D20 (1)
Weight, g/mol:	306.125594
ΔH_f, kcal/mol:	9.56
Dipole, Da:	4.07
IP(EA), eV:	-8.16(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1R)-3-oxo-1-phenylpentyl]indene-1,3-dione

Drug info:

PubChemData

Smile

CC1=C(C2=NC(=CC(=C2C=C1)NC3=CC=CC=C3OC)C)C

DOS

IR

Vibrations