Geometry & MOs

Info

ID:	403067
PubChem CID:	135058593
Reduced:	N2C25H34 (1)
Stoich.:	A2B25C34 (1)
Weight, g/mol:	254.13068
ΔH_f, kcal/mol:	7.33
Dipole, Da:	1.87
IP(EA), eV:	-8.72(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[2-(4-methoxyphenyl)ethyl]phenyl]ethanone

Drug info:

PubChemData

Smile

C1CCC(CC1)C(C2=CC=CC(=N2)CC3=CC=CC=C3)NC4CCCCC4

DOS

IR

Vibrations