Geometry & MOs

Info

ID:	78183
PubChem CID:	49681774
Reduced:	N3O4C18H29 (1)
Stoich.:	A3B4C18D29 (1)
Weight, g/mol:	360.179755
ΔH_f, kcal/mol:	-162.69
Dipole, Da:	1.18
IP(EA), eV:	-8.52(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-[(2,5-dimethylfuran-3-yl)methyl]piperidin-4-yl]methyl]-N'-(1,2-oxazol-3-yl)oxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(O1)C)CN2CCC(CC2)CNC(=O)C(=O)NCCOC

DOS

IR

Vibrations