Geometry & MOs

Info

ID:	182730
PubChem CID:	76931593
Reduced:	NO3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	265.111422
ΔH_f, kcal/mol:	-116.74
Dipole, Da:	8.25
IP(EA), eV:	-9.48(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[3-(3-fluorophenyl)prop-2-enoylamino]pentanoic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C=CC(=O)N(CC(C)C)CC(=O)O

DOS

IR

Vibrations