Geometry & MOs

Info

ID:	175058
PubChem CID:	75850142
Reduced:	NF4O4H11C15 (1)
Stoich.:	AB4C4D11E15 (1)
Weight, g/mol:	299.152144
ΔH_f, kcal/mol:	-290.26
Dipole, Da:	4.65
IP(EA), eV:	-9.82(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

prop-2-enyl 2-cyano-3-(4-pentoxyphenyl)prop-2-enoate

Drug info:

PubChemData

Smile

C=CCOC(=O)C(=CC1=C(C=C(C=C1)OC(F)F)OC(F)F)C#N

DOS

IR

Vibrations