Geometry & MOs

Info

ID:	298851
PubChem CID:	117661744
Reduced:	O3H7C12F13 (1)
Stoich.:	A3B7C12D13 (1)
Weight, g/mol:	280.157563
ΔH_f, kcal/mol:	-751.57
Dipole, Da:	4.13
IP(EA), eV:	-10.79(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-bis(2,5-dimethylpyrrol-1-yl)phenol

Drug info:

PubChemData

Smile

C=CC(=O)OCC(=O)CC(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

DOS

IR

Vibrations