Geometry & MOs

Info

ID:	13043
PubChem CID:	220312
Reduced:	ClO3C10H11 (1)
Stoich.:	AB3C10D11 (1)
Weight, g/mol:	214.039672
ΔH_f, kcal/mol:	-121.7
Dipole, Da:	3.39
IP(EA), eV:	-9.37(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chlorophenyl) propan-2-yl carbonate

Drug info:

PubChemData

Smile

CC(C)OC(=O)OC1=CC=C(C=C1)Cl

DOS

IR

Vibrations