Geometry & MOs

Info

ID:	179745
PubChem CID:	76525412
Reduced:	O7C28H44 (1)
Stoich.:	A7B28C44 (1)
Weight, g/mol:	325.167794
ΔH_f, kcal/mol:	-299.88
Dipole, Da:	5.12
IP(EA), eV:	-8.87(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[4-[2-(dimethylamino)ethoxy]phenyl]-3-phenylprop-2-enoate

Drug info:

PubChemData

Smile

CCCC1CC(CC(C=CCC(CC(CC(=O)O1)OCC2=CC=C(C=C2)OC)OCOC)C)OC

DOS

IR

Vibrations