Geometry & MOs

Info

ID:	159006
PubChem CID:	57244509
Reduced:	BrPN2C3H4O4 (1)
Stoich.:	ABC2D3E4F4 (1)
Weight, g/mol:	392.27153
ΔH_f, kcal/mol:	-188.08
Dipole, Da:	4.95
IP(EA), eV:	-9.4(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tetradecoxyfluoren-9-one

Drug info:

PubChemData

Smile

C1(=C(N=C(N1)P(=O)(O)O)O)Br

DOS

IR

Vibrations