Geometry & MOs

Info

ID:

49168

PubChem CID:

11528782

Reduced:

FN2O2C9H11 (1)

Stoich.:

AB2C2D9E11 (1)

Weight, g/mol:

234.044757

ΔHf, kcal/mol:

-113.24

Dipole, Da:

2.18

IP(EA), eV:

-9.13(-0.47)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(5-chloro-2-phenoxyphenyl)methanol

Drug info:

PubChemData

Smile

COC(=O)NC1=C(C=C(C=C1)CN)F

DOS

IR

Vibrations