Geometry & MOs

Info

ID:	299850
PubChem CID:	117695937
Reduced:	N2O3C17H22 (1)
Stoich.:	A2B3C17D22 (1)
Weight, g/mol:	373.163771
ΔH_f, kcal/mol:	-111.12
Dipole, Da:	3.31
IP(EA), eV:	-9.99(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-tert-butyl-N-[3-methyl-4-(4-nitrophenyl)-4-oxobutan-2-yl]-1,2-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C(C)NC(=O)OC(C)(C)C)C(=O)C1=CC=C(C=C1)C#N

DOS

IR

Vibrations