Geometry & MOs

Info

ID:	178897
PubChem CID:	76399110
Reduced:	ON2C6H8 (3)
Stoich.:	AB2C6D8 (3)
Weight, g/mol:	346.164105
ΔH_f, kcal/mol:	-41.91
Dipole, Da:	3.44
IP(EA), eV:	-9.05(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-amino-3-hydroxy-1-oxobutan-2-yl)-5-[[benzyl(methyl)amino]methyl]-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=NC(=NO1)CNC(=O)C2=CN=C(C=C2)NC3CCCCNC3=O

DOS

IR

Vibrations