Geometry & MOs

Info

ID:	407571
PubChem CID:	135080319
Reduced:	ClON2C11H13 (1)
Stoich.:	ABC2D11E13 (1)
Weight, g/mol:	218.02652
ΔH_f, kcal/mol:	-34.97
Dipole, Da:	4.21
IP(EA), eV:	-9.0(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-2,3-dichloropropoxy]methylbenzene

Drug info:

PubChemData

Smile

CC(C)(C)N1C(=O)CC2=C1C=CC(=N2)Cl

DOS

IR

Vibrations