Geometry & MOs

Info

ID:	374897
PubChem CID:	131349701
Reduced:	NO2C10H11 (1)
Stoich.:	AB2C10D11 (1)
Weight, g/mol:	202.080536
ΔH_f, kcal/mol:	-44.3
Dipole, Da:	3.82
IP(EA), eV:	-8.9(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(difluoromethyl)-4-ethoxy-2-methylphenol

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C(=C1)C#N)C)O

DOS

IR

Vibrations