Geometry & MOs

Info

ID:	26996
PubChem CID:	810586
Reduced:	NO2C16H21 (1)
Stoich.:	AB2C16D21 (1)
Weight, g/mol:	345.205242
ΔH_f, kcal/mol:	-56.7
Dipole, Da:	2.18
IP(EA), eV:	-8.26(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C=C2C=NC3(CCCCC3)CC2=C1)OC

DOS

IR

Vibrations