Geometry & MOs

Info

ID:	48952
PubChem CID:	11528515
Reduced:	NO2C11H17 (1)
Stoich.:	AB2C11D17 (1)
Weight, g/mol:	194.989862
ΔH_f, kcal/mol:	-53.77
Dipole, Da:	2.12
IP(EA), eV:	-8.97(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(difluoromethyl)-2-methyl-1,3-oxazole-5-carbonyl chloride

Drug info:

PubChemData

Smile

CCC[C@@H](CO)ONC1=CC=CC=C1

DOS

IR

Vibrations