Geometry & MOs

Info

ID:	414982
PubChem CID:	135087962
Reduced:	N2O3C20H26 (1)
Stoich.:	A2B3C20D26 (1)
Weight, g/mol:	405.181919
ΔH_f, kcal/mol:	-68.91
Dipole, Da:	5.88
IP(EA), eV:	-8.88(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(4-chlorophenyl)-3-(2-methoxyethylamino)-1,2-oxazol-4-yl]-(3-propan-2-ylpiperidin-1-yl)methanone

Drug info:

PubChemData

Smile

C=CCC1=C(C=CC(=C1)CN2C[C@@H]3COC[C@H](C2)NC3=O)OCC=C

DOS

IR

Vibrations