Geometry & MOs

Info

ID:	349789
PubChem CID:	127276181
Reduced:	N2O3C18H26 (1)
Stoich.:	A2B3C18D26 (1)
Weight, g/mol:	346.189257
ΔH_f, kcal/mol:	-116.74
Dipole, Da:	3.56
IP(EA), eV:	-7.82(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-(oxane-3-carbonylamino)phenyl]methyl]oxane-3-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1N2CCC(C2)CNC(=O)C3CCCOC3

DOS

IR

Vibrations