Geometry & MOs

Info

ID:	255644
PubChem CID:	103133707
Reduced:	OSN2C10H14 (1)
Stoich.:	ABC2D10E14 (1)
Weight, g/mol:	318.069258
ΔH_f, kcal/mol:	-7.42
Dipole, Da:	6.92
IP(EA), eV:	-8.3(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dimethyl-4-[(5-methyloxolan-2-yl)methoxy]benzenesulfonyl chloride

Drug info:

PubChemData

Smile

CC1(CCCS1)C(=O)C2=NN(C=C2)C

DOS

IR

Vibrations