Geometry & MOs

Info

ID:	48937
PubChem CID:	11528496
Reduced:	O3C11H12 (1)
Stoich.:	A3B11C12 (1)
Weight, g/mol:	192.078644
ΔH_f, kcal/mol:	-100.92
Dipole, Da:	0.87
IP(EA), eV:	-9.63(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(2-methylphenyl)oxirane-2-carboxylate

Drug info:

PubChemData

Smile

C1[C@H](O[C@@H](C1=O)C2=CC=CC=C2)CO

DOS

IR

Vibrations