Geometry & MOs

Info

ID:	14407
PubChem CID:	410837
Reduced:	NOH21C22 (1)
Stoich.:	ABC21D22 (1)
Weight, g/mol:	315.162314
ΔH_f, kcal/mol:	38.09
Dipole, Da:	3.38
IP(EA), eV:	-9.08(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(benzylamino)-1,3-diphenylpropan-1-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CNC(CC(=O)C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations