Geometry & MOs

Info

ID:	18039
PubChem CID:	534964
Reduced:	N4O5F9C16H19 (1)
Stoich.:	A4B5C9D16E19 (1)
Weight, g/mol:	518.121173
ΔH_f, kcal/mol:	-671.31
Dipole, Da:	6.17
IP(EA), eV:	-10.74(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl 5-[bis[(2,2,2-trifluoroacetyl)amino]methylideneamino]-2-[(2,2,2-trifluoroacetyl)amino]pentanoate

Drug info:

PubChemData

Smile

CCCCOC(=O)C(CCCN=C(NC(=O)C(F)(F)F)NC(=O)C(F)(F)F)NC(=O)C(F)(F)F

DOS

IR

Vibrations