Geometry & MOs

Info

ID:	198742
PubChem CID:	79144757
Reduced:	NO2C11H11 (1)
Stoich.:	AB2C11D11 (1)
Weight, g/mol:	127.063329
ΔH_f, kcal/mol:	-35.31
Dipole, Da:	3.9
IP(EA), eV:	-9.29(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-ethyl-1,3-oxazol-4-yl)methanol

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=C(N=CO2)CO

DOS

IR

Vibrations