Geometry & MOs

Info

ID:	344131
PubChem CID:	127267307
Reduced:	NOC6H9 (3)
Stoich.:	ABC6D9 (3)
Weight, g/mol:	327.119461
ΔH_f, kcal/mol:	-94.06
Dipole, Da:	2.93
IP(EA), eV:	-9.01(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[2-(dimethylamino)ethyl]phenyl]-4-(trifluoromethyl)-1,3-oxazole-5-carboxamide

Drug info:

PubChemData

Smile

CCCCOC1=C(C=CC=N1)CNC(=O)C2(CC2)N3CCOCC3

DOS

IR

Vibrations