Geometry & MOs

Info

ID:	411859
PubChem CID:	135084704
Reduced:	NPPdO2C20H34 (1)
Stoich.:	ABCD2E20F34 (1)
Weight, g/mol:	219.125929
ΔH_f, kcal/mol:	-41.59
Dipole, Da:	4.71
IP(EA), eV:	-7.35(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-4-[(2-methoxyphenyl)methylamino]pent-3-en-2-one

Drug info:

PubChemData

Smile

[CH3-].CCP(CC)CC.C/C(=C/C(=O)C)/[N-]CC1=CC=CC=C1OC.[Pd+2]

DOS

IR

Vibrations