Geometry & MOs

Info

ID:	346437
PubChem CID:	127270941
Reduced:	O2N5C19H25 (1)
Stoich.:	A2B5C19D25 (1)
Weight, g/mol:	355.153206
ΔH_f, kcal/mol:	-37.35
Dipole, Da:	6.13
IP(EA), eV:	-9.17(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-2-oxoethyl]-5-phenyl-1,2-oxazole-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC(=O)N(CC1)CC(=O)N2CCC(CC2)C3=NN=C4N3C=CC=C4

DOS

IR

Vibrations