Geometry & MOs

Info

ID:	414441
PubChem CID:	135087399
Reduced:	NO2C20H25 (1)
Stoich.:	AB2C20D25 (1)
Weight, g/mol:	361.18017
ΔH_f, kcal/mol:	-69.97
Dipole, Da:	4.5
IP(EA), eV:	-9.27(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclobutylmethyl)-3-(dimethylamino)-5-(4-fluoro-3-methoxyphenyl)-N-methyl-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

C1C[C@@H]2CN(C[C@@H]2[C@](C1)(C3=CC=CC=C3)O)C(=O)C4CC=CC4

DOS

IR

Vibrations