Geometry & MOs

Info

ID:	27001
PubChem CID:	810616
Reduced:	SN2O3C14H16 (1)
Stoich.:	AB2C3D14E16 (1)
Weight, g/mol:	293.137556
ΔH_f, kcal/mol:	-84.93
Dipole, Da:	3.28
IP(EA), eV:	-8.76(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-2-[[cyclopropyl-(2-methoxyacetyl)amino]methyl]-1,3-oxazole-4-carboxamide

Drug info:

PubChemData

Smile

CCN1C(=S)N([C@@]2([C@]1(C3=CC=CC=C3C2=O)O)O)CC

DOS

IR

Vibrations