Geometry & MOs

Info

ID:	353506
PubChem CID:	127285083
Reduced:	SO2N4C19H24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	296.209993
ΔH_f, kcal/mol:	-25.52
Dipole, Da:	4.14
IP(EA), eV:	-8.81(-1.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-pyrrolidin-1-yloxan-4-yl)methyl]oxane-3-carboxamide

Drug info:

PubChemData

Smile

C1CCN(C1)C2(CCOCC2)CNC(=O)C3=CN=C(S3)C4=CC=CC=N4

DOS

IR

Vibrations