Geometry & MOs

Info

ID:	369237
PubChem CID:	127331554
Reduced:	N2O3C20H28 (1)
Stoich.:	A2B3C20D28 (1)
Weight, g/mol:	390.17102
ΔH_f, kcal/mol:	-114.52
Dipole, Da:	2.16
IP(EA), eV:	-9.54(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(C)C1C(CCCO1)CNC(=O)CCC2=NC3=CC=CC=C3O2

DOS

IR

Vibrations