Geometry & MOs

Info

ID:	388180
PubChem CID:	134988477
Reduced:	IOPC11H22 (1)
Stoich.:	ABCD11E22 (1)
Weight, g/mol:	230.094294
ΔH_f, kcal/mol:	-64.8
Dipole, Da:	2.49
IP(EA), eV:	-8.52(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R,4S)-3-methyl-4-(3-phenylmethoxyprop-1-ynyl)oxetan-2-one

Drug info:

PubChemData

Smile

CCO/C(=C(/C)\P(C(C)C)C(C)C)/I

DOS

IR

Vibrations