Geometry & MOs

Info

ID:	83609
PubChem CID:	49858831
Reduced:	N3O4C23H25 (1)
Stoich.:	A3B4C23D25 (1)
Weight, g/mol:	240.078644
ΔH_f, kcal/mol:	-81.48
Dipole, Da:	7.0
IP(EA), eV:	-8.84(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenyl (2S,3S)-3-phenyloxirane-2-carboxylate

Drug info:

PubChemData

Smile

CCN1C(=C(C(N=C1NCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4)C(=O)OC)C

DOS

IR

Vibrations