Geometry & MOs

Info

ID:	415174
PubChem CID:	135088165
Reduced:	NO2C8H9 (2)
Stoich.:	AB2C8D9 (2)
Weight, g/mol:	416.185983
ΔH_f, kcal/mol:	-95.77
Dipole, Da:	3.56
IP(EA), eV:	-8.99(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(dimethylamino)-5-(4-fluoro-3-methoxyphenyl)-N-[[3-(2-methylpropyl)-1,2-oxazol-5-yl]methyl]-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1(CCCN(C1)C2=NOC(=C2C(=O)O)C3=CC=CC=C3)O

DOS

IR

Vibrations