Geometry & MOs

Info

ID:	29900
PubChem CID:	838062
Reduced:	O2N4C15H18 (1)
Stoich.:	A2B4C15D18 (1)
Weight, g/mol:	281.141579
ΔH_f, kcal/mol:	29.71
Dipole, Da:	10.22
IP(EA), eV:	-5.36(-2.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-(4-benzoylphenyl)-2-methylbutanamide

Drug info:

PubChemData

Smile

C1=C[N+](=CC=C1C(=O)N)CCC[N+]2=CC=C(C=C2)C(=O)N

DOS

IR

Vibrations