Geometry & MOs

Info

ID:	369192
PubChem CID:	127331494
Reduced:	N2O3C23H34 (1)
Stoich.:	A2B3C23D34 (1)
Weight, g/mol:	343.189592
ΔH_f, kcal/mol:	-155.03
Dipole, Da:	2.74
IP(EA), eV:	-9.39(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-tert-butyloxan-3-yl)methyl]-5-pyridin-4-yl-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CN2CC(CC2=O)C(=O)NCC3CCCOC3C(C)(C)C

DOS

IR

Vibrations