Geometry & MOs

Info

ID:	439070
PubChem CID:	135228833
Reduced:	N2O3C22H26 (1)
Stoich.:	A2B3C22D26 (1)
Weight, g/mol:	227.1674
ΔH_f, kcal/mol:	-87.97
Dipole, Da:	7.25
IP(EA), eV:	-9.18(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-2-(2-pent-4-en-2-ylphenyl)prop-1-enyl]ethanimine

Drug info:

PubChemData

Smile

CC(=N)C1=C(C=C2C(=C1)CC(N3C2=CC(=O)C(=C3)C(=O)C)C(C)(C)C)OC

DOS

IR

Vibrations