Geometry & MOs

Info

ID:	12167
PubChem CID:	131792
Reduced:	FN5O5C21H34 (1)
Stoich.:	AB5C5D21E34 (1)
Weight, g/mol:	455.254397
ΔH_f, kcal/mol:	-299.86
Dipole, Da:	4.87
IP(EA), eV:	-9.83(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-fluoro-2,4-dioxo-N-[6-[[2-(2-propylpentanoylamino)acetyl]amino]hexyl]pyrimidine-1-carboxamide

Drug info:

PubChemData

Smile

CCCC(CCC)C(=O)NCC(=O)NCCCCCCNC(=O)N1C=C(C(=O)NC1=O)F

DOS

IR

Vibrations