Geometry & MOs

Info

ID:	58683
PubChem CID:	24714723
Reduced:	NOC9H13 (2)
Stoich.:	ABC9D13 (2)
Weight, g/mol:	346.225643
ΔH_f, kcal/mol:	-22.23
Dipole, Da:	4.88
IP(EA), eV:	-9.07(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methylpropoxy)-3-[(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl-prop-2-enylamino]propan-2-ol

Drug info:

PubChemData

Smile

CCCC(CN(CC=C)CC1CC(=NO1)C2=CC=CC=C2)O

DOS

IR

Vibrations