Geometry & MOs

Info

ID:	160210
PubChem CID:	57309556
Reduced:	N2O5C28H46 (1)
Stoich.:	A2B5C28D46 (1)
Weight, g/mol:	262.100523
ΔH_f, kcal/mol:	-262.25
Dipole, Da:	4.2
IP(EA), eV:	-9.25(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,5-dimethoxyphenyl)-3-fluoro-5-methylphenol

Drug info:

PubChemData

Smile

CCCCNC(=O)C(=C)C[C@@H]([C@H](C[C@H](COCC1=CC=CC=C1)C(C)C)NC(=O)OC(C)(C)C)O

DOS

IR

Vibrations