Geometry & MOs

Info

ID:	78210
PubChem CID:	49681807
Reduced:	N3O3C23H35 (1)
Stoich.:	A3B3C23D35 (1)
Weight, g/mol:	403.166269
ΔH_f, kcal/mol:	-128.94
Dipole, Da:	0.81
IP(EA), eV:	-8.61(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=C(O1)C)CN2CCC(CC2)CNC(=O)C(=O)NCCC3=CCCCC3

DOS

IR

Vibrations