Geometry & MOs

Info

ID:	264270
PubChem CID:	103448633
Reduced:	O2C9H18 (1)
Stoich.:	A2B9C18 (1)
Weight, g/mol:	198.105608
ΔH_f, kcal/mol:	-117.94
Dipole, Da:	2.63
IP(EA), eV:	-10.03(2.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-fluorophenyl)-2-methylbutane-1,2-diol

Drug info:

PubChemData

Smile

CCC(C)(C(C1CCC1)O)O

DOS

IR

Vibrations