Geometry & MOs

Info

ID:	178958
PubChem CID:	76407567
Reduced:	SO2N3C18H25 (1)
Stoich.:	AB2C3D18E25 (1)
Weight, g/mol:	356.184841
ΔH_f, kcal/mol:	-55.06
Dipole, Da:	5.06
IP(EA), eV:	-9.26(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-cyclopentyl-2-oxo-3a,4,6,6a-tetrahydropyrrolo[3,4-d][1,3]oxazol-5-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC1CN(CCC1(C)O)C(=O)C2=C(NN=C2)C3=CC=CS3

DOS

IR

Vibrations