Geometry & MOs

Info

ID:	29755
PubChem CID:	836930
Reduced:	NO4C16H25 (1)
Stoich.:	AB4C16D25 (1)
Weight, g/mol:	281.177964
ΔH_f, kcal/mol:	-159.16
Dipole, Da:	2.69
IP(EA), eV:	-8.44(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-4-methylpentan-2-yl]-4-phenylbenzamide

Drug info:

PubChemData

Smile

C[C@@H](CC(C)C)NC(=O)C1=CC(=C(C(=C1)OC)OC)OC

DOS

IR

Vibrations