Geometry & MOs

Info

ID:	232190
PubChem CID:	87575677
Reduced:	NO5C40H81 (1)
Stoich.:	AB5C40D81 (1)
Weight, g/mol:	157.073893
ΔH_f, kcal/mol:	-385.33
Dipole, Da:	4.41
IP(EA), eV:	-9.93(1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-aminoacetyl) pent-4-enoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCOC(CC)C(CCCCCCCCCCC)C(CC(CO)O)(C(CC)OC)C(=O)N

DOS

IR

Vibrations