Geometry & MOs

Info

ID:	78217
PubChem CID:	49681816
Reduced:	N3O5C22H27 (1)
Stoich.:	A3B5C22D27 (1)
Weight, g/mol:	413.231456
ΔH_f, kcal/mol:	-155.13
Dipole, Da:	1.54
IP(EA), eV:	-8.63(-0.7)
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'-(2-methoxy-5-methylphenyl)oxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(O1)C)CN2CCC(CC2)CNC(=O)C(=O)NC3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations