Geometry & MOs

Info

ID:	225042
PubChem CID:	85735829
Reduced:	O3C23H24 (1)
Stoich.:	A3B23C24 (1)
Weight, g/mol:	334.097187
ΔH_f, kcal/mol:	-79.93
Dipole, Da:	2.23
IP(EA), eV:	-8.93(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-2-[4-[[4-(oxiran-2-ylmethoxy)phenyl]methyl]phenoxy]ethanol

Drug info:

PubChemData

Smile

CC(=O)O.C=CCC1(CC2=CC=CC=C2C1O)C3=CCC4=CC=CC=C43

DOS

IR

Vibrations