Geometry & MOs

Info

ID:	403736
PubChem CID:	135061637
Reduced:	NO2C31H31 (1)
Stoich.:	AB2C31D31 (1)
Weight, g/mol:	284.141245
ΔH_f, kcal/mol:	-24.12
Dipole, Da:	1.96
IP(EA), eV:	-9.03(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(4-ethenyl-2,5-dihydrofuran-3-yl)-4-phenylbut-3-enoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCC1=CC=C(C=C1)[C@H](C2=CC=CC=C2)C3=CC=C(C=C3)C4=CC=CC=C4

DOS

IR

Vibrations