Geometry & MOs

Info

ID:	382866
PubChem CID:	134974264
Reduced:	LiNO2C23H28 (1)
Stoich.:	ABC2D23E28 (1)
Weight, g/mol:	351.219829
ΔH_f, kcal/mol:	-61.21
Dipole, Da:	9.32
IP(EA), eV:	-7.85(0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-[benzyl(prop-2-enyl)amino]-1-[(2-methylpropan-2-yl)oxy]-3-phenylprop-1-en-1-ol

Drug info:

PubChemData

Smile

[Li+].CC(C)(C)O/C(=C/C(C1=CC=CC=C1)N(CC=C)CC2=CC=CC=C2)/[O-]

DOS

IR

Vibrations