Geometry & MOs

Info

ID:	298792
PubChem CID:	117656877
Reduced:	OSCl2F3N3H12C15 (1)
Stoich.:	ABC2D3E3F12G15 (1)
Weight, g/mol:	201.209264
ΔH_f, kcal/mol:	-126.36
Dipole, Da:	3.45
IP(EA), eV:	-8.98(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-methyl-N-[2-(2-methylbutan-2-yloxy)ethyl]butan-1-amine

Drug info:

PubChemData

Smile

CN=C(C1=CN=CC=C1)NC2=CC(=C(C=C2Cl)Cl)S(=O)CC(F)(F)F

DOS

IR

Vibrations