Geometry & MOs

Info

ID:	171520
PubChem CID:	75387763
Reduced:	FNO3C13H18 (1)
Stoich.:	ABC3D13E18 (1)
Weight, g/mol:	307.225977
ΔH_f, kcal/mol:	-163.45
Dipole, Da:	7.56
IP(EA), eV:	-8.82(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propyl]-3,5-dimethylazepane-1-carboxamide

Drug info:

PubChemData

Smile

CC(COC(=O)C1=C(C=C(C=C1)N(C)C)F)OC

DOS

IR

Vibrations