Geometry & MOs

Info

ID:	418201
PubChem CID:	135103860
Reduced:	O2N3C26H29 (1)
Stoich.:	A2B3C26D29 (1)
Weight, g/mol:	351.134969
ΔH_f, kcal/mol:	-18.85
Dipole, Da:	5.32
IP(EA), eV:	-9.27(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-butan-2-yl]-5-(4-chlorophenyl)-3-(2-methoxyethylamino)-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCC1N[C@@H]2COC[C@H]2CC3=CC=NC4=CC=CC=C34)C(=O)C5=CC=CC=C5

DOS

IR

Vibrations