Geometry & MOs

Info

ID:	357732
PubChem CID:	127294406
Reduced:	SO2N4C16H22 (1)
Stoich.:	AB2C4D16E22 (1)
Weight, g/mol:	278.143056
ΔH_f, kcal/mol:	-34.57
Dipole, Da:	6.52
IP(EA), eV:	-8.9(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(2-fluorophenyl)pyrrolidin-1-yl]-morpholin-4-ylmethanone

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)CCNC(=O)NC2=NC3=C(S2)CCCCC3

DOS

IR

Vibrations