Geometry & MOs

Info

ID:	345311
PubChem CID:	127269560
Reduced:	FSO4N5C15H18 (1)
Stoich.:	ABC4D5E15F18 (1)
Weight, g/mol:	319.16444
ΔH_f, kcal/mol:	-130.12
Dipole, Da:	8.25
IP(EA), eV:	-8.65(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-morpholin-4-ylpyridin-3-yl)-3-(2-oxopiperidin-3-yl)urea

Drug info:

PubChemData

Smile

CC1=NOC(=N1)C(C)NC(=O)NC2=C(C=CC(=C2)N3CCCS3(=O)=O)F

DOS

IR

Vibrations