Geometry & MOs

Info

ID:	326602
PubChem CID:	126687863
Reduced:	OF3N5C33H34 (1)
Stoich.:	AB3C5D33E34 (1)
Weight, g/mol:	208.109944
ΔH_f, kcal/mol:	-46.88
Dipole, Da:	5.15
IP(EA), eV:	-8.88(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-prop-2-enoxy-2,3-bis(prop-2-ynoxy)propane

Drug info:

PubChemData

Smile

C1CC1CN(CC2CC2)C(C3=CC=CC=C3)C4=CC(=CC=C4)NC(=O)C5=CC(=NN5C6=CC=CC(=C6)CN)C(F)(F)F

DOS

IR

Vibrations