Geometry & MOs

Info

ID:	399579
PubChem CID:	135041056
Reduced:	OC15H18 (1)
Stoich.:	AB15C18 (1)
Weight, g/mol:	245.177964
ΔH_f, kcal/mol:	26.22
Dipole, Da:	1.66
IP(EA), eV:	-9.09(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methylbut-2-enyl)-N-[(1S)-1-phenylethyl]propanamide

Drug info:

PubChemData

Smile

CC(C)(CC#CC1=CC=CC=C1)OCC=C

DOS

IR

Vibrations