Geometry & MOs

Info

ID:	416284
PubChem CID:	135089296
Reduced:	O2N4C19H24 (1)
Stoich.:	A2B4C19D24 (1)
Weight, g/mol:	336.159769
ΔH_f, kcal/mol:	-22.24
Dipole, Da:	6.3
IP(EA), eV:	-9.09(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)N2C=CC=N2)CN3C[C@@H]4COC[C@H](C3)NC4=O)C

DOS

IR

Vibrations