Geometry & MOs

Info

ID:	26999
PubChem CID:	810613
Reduced:	N3O3C19H21 (1)
Stoich.:	A3B3C19D21 (1)
Weight, g/mol:	345.114713
ΔH_f, kcal/mol:	-31.98
Dipole, Da:	4.61
IP(EA), eV:	-9.62(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(=O)N(CC2=NC(=CO2)C(=O)NC3CC3)C4CC4

DOS

IR

Vibrations