Geometry & MOs

Info

ID:	395081
PubChem CID:	135024616
Reduced:	H8C9 (3)
Stoich.:	A8B9 (3)
Weight, g/mol:	370.135114
ΔH_f, kcal/mol:	280.49
Dipole, Da:	2.15
IP(EA), eV:	-9.26(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1-(benzenesulfonyl)-2-methyl-3-phenylaziridin-2-yl]-4,4-dimethyl-5H-1,3-oxazole

Drug info:

PubChemData

Smile

C#CCC(CC#C)C1=CC(=C(C=C1)C(CC#C)CC#C)C(CC#C)CC#C

DOS

IR

Vibrations