Geometry & MOs

Info

ID:	305433
PubChem CID:	124807235
Reduced:	N3O3C17H23 (1)
Stoich.:	A3B3C17D23 (1)
Weight, g/mol:	333.205242
ΔH_f, kcal/mol:	-71.66
Dipole, Da:	4.9
IP(EA), eV:	-9.57(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[(1R,3aR,7aR)-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-3,3a,4,6,7,7a-hexahydro-1H-furo[3,4-c]pyridin-1-yl]methyl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)[C@]23CN(C[C@H]2COC3)C(=O)CC4=CCCCC4

DOS

IR

Vibrations