Geometry & MOs

Info

ID:	244954
PubChem CID:	99431659
Reduced:	FO3N4C24H29 (1)
Stoich.:	AB3C4D24E29 (1)
Weight, g/mol:	402.145868
ΔH_f, kcal/mol:	-151.55
Dipole, Da:	5.93
IP(EA), eV:	-8.64(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[(3R)-1-(5-chloro-6-oxo-1H-pyridine-3-carbonyl)piperidin-3-yl]methyl]-3-(4-methylphenyl)urea

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)NC[C@H]2CCCN(C2)C(=O)CCNC(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations