Geometry & MOs

Info

ID:

182134

PubChem CID:

76852189

Reduced:

ClNO4C11H16 (1)

Stoich.:

ABC4D11E16 (1)

Weight, g/mol:

186.044757

ΔHf, kcal/mol:

-175.91

Dipole, Da:

6.87

IP(EA), eV:

-9.13(-0.35)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(1-chloropropan-2-yloxy)phenol

Drug info:

PubChemData

Smile

CC(CCl)OC1=CC=CC=C1O.CNC(=O)O

DOS

IR

Vibrations