Geometry & MOs

Info

ID:	414164
PubChem CID:	135087120
Reduced:	NOC15H17 (1)
Stoich.:	ABC15D17 (1)
Weight, g/mol:	192.11503
ΔH_f, kcal/mol:	23.5
Dipole, Da:	1.19
IP(EA), eV:	-9.23(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-phenylbutan-2-yloxy)acetaldehyde

Drug info:

PubChemData

Smile

CC(C)[C@@H](C1=CC=CC=C1)N=CC2=CC=CO2

DOS

IR

Vibrations