Geometry & MOs

Info

ID:	444525
PubChem CID:	135262729
Reduced:	NOC19H27 (1)
Stoich.:	ABC19D27 (1)
Weight, g/mol:	285.209264
ΔH_f, kcal/mol:	-33.08
Dipole, Da:	3.79
IP(EA), eV:	-9.39(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-benzylidene-N,2-dimethyldec-2-enamide

Drug info:

PubChemData

Smile

CCCCCC/C(=C\C1=CC=CC=C1)/C=C(\C)/C(=O)NC

DOS

IR

Vibrations