Geometry & MOs

Info

ID:	403140
PubChem CID:	135058923
Reduced:	NH19C20 (1)
Stoich.:	AB19C20 (1)
Weight, g/mol:	254.13068
ΔH_f, kcal/mol:	62.84
Dipole, Da:	2.56
IP(EA), eV:	-9.01(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[1-(2-methoxyphenyl)ethyl]phenyl]ethanone

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(C)C2=CC=CC=C2C3=CC=CC=N3

DOS

IR

Vibrations