Geometry & MOs

Info

ID:	342309
PubChem CID:	127265086
Reduced:	NO3C18H23 (1)
Stoich.:	AB3C18D23 (1)
Weight, g/mol:	233.105193
ΔH_f, kcal/mol:	-123.08
Dipole, Da:	3.67
IP(EA), eV:	-9.38(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-phenylpent-4-enoylamino)acetic acid

Drug info:

PubChemData

Smile

CCC(=CC(=O)N1CCC(CC1)C(=O)O)C2=CC=C(C=C2)C

DOS

IR

Vibrations