Geometry & MOs

Info

ID:	391286
PubChem CID:	135004121
Reduced:	N2O5H12C15 (1)
Stoich.:	A2B5C12D15 (1)
Weight, g/mol:	328.04628
ΔH_f, kcal/mol:	-5.43
Dipole, Da:	7.93
IP(EA), eV:	-9.96(-1.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,2S)-1-(4-bromophenyl)-2-methyl-5-phenylpent-3-en-1-one

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C(=O)CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations