Geometry & MOs

Info

ID:	232693
PubChem CID:	87576734
Reduced:	NO3C21H25 (1)
Stoich.:	AB3C21D25 (1)
Weight, g/mol:	202.09938
ΔH_f, kcal/mol:	-125.93
Dipole, Da:	5.69
IP(EA), eV:	-9.35(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-phenylethenyl)pent-2-enoic acid

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)(C3)N(C=O)C4(CC5=CC=CC=C5C4)C(=O)O

DOS

IR

Vibrations