Geometry & MOs

Info

ID:	46349
PubChem CID:	10523994
Reduced:	SiO2C24H34 (1)
Stoich.:	AB2C24D34 (1)
Weight, g/mol:	382.064173
ΔH_f, kcal/mol:	-108.64
Dipole, Da:	1.78
IP(EA), eV:	-8.69(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-chloro-7-methoxy-3,4-dihydro-2H-chromen-2-yl)methyl 4-methylbenzenesulfonate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations