Geometry & MOs

Info

ID:	399344
PubChem CID:	135039767
Reduced:	ClO2H15C17 (1)
Stoich.:	AB2C15D17 (1)
Weight, g/mol:	249.136493
ΔH_f, kcal/mol:	-35.92
Dipole, Da:	3.31
IP(EA), eV:	-9.57(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(benzylamino)-5-ethenyl-5-methoxyoxolan-3-ol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(CC(=O)/C=C/C2=CC=C(C=C2)Cl)O

DOS

IR

Vibrations