Geometry & MOs

Info

ID:	384768
PubChem CID:	134977635
Reduced:	NP2O4C8H19 (1)
Stoich.:	AB2C4D8E19 (1)
Weight, g/mol:	317.199094
ΔH_f, kcal/mol:	-296.32
Dipole, Da:	1.89
IP(EA), eV:	-9.79(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-methyl-N-[[(3R)-4-methyl-1-phenylpent-1-yn-3-yl]oxymethyl]carbamate

Drug info:

PubChemData

Smile

CCCOP(=O)(C)N1CCP1(=O)OCC

DOS

IR

Vibrations