Geometry & MOs

Info

ID:	395717
PubChem CID:	135026325
Reduced:	N2F3H11C19 (1)
Stoich.:	A2B3C11D19 (1)
Weight, g/mol:	465.248838
ΔH_f, kcal/mol:	-53.13
Dipole, Da:	6.41
IP(EA), eV:	-9.61(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-azidopropylamino)-N-benzyl-N-[2-[benzyl-[2-(methylamino)-2-oxoethyl]amino]-2-oxoethyl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=C(N=C3C(=C2)C=CC4=C3N=CC=C4)C(F)(F)F

DOS

IR

Vibrations