Geometry & MOs

Info

ID:	328966
PubChem CID:	126729688
Reduced:	NO3C7H11 (1)
Stoich.:	AB3C7D11 (1)
Weight, g/mol:	281.177964
ΔH_f, kcal/mol:	-90.07
Dipole, Da:	4.27
IP(EA), eV:	-8.82(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-benzyl-1-[4-(ethylamino)phenyl]butan-1-one

Drug info:

PubChemData

Smile

CC(C)NC1=C(C(C1=O)O)O

DOS

IR

Vibrations