Geometry & MOs

Info

ID:	329406
PubChem CID:	126736355
Reduced:	N3H29C43 (1)
Stoich.:	A3B29C43 (1)
Weight, g/mol:	233.089937
ΔH_f, kcal/mol:	248.75
Dipole, Da:	4.67
IP(EA), eV:	-7.93(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(2-aminoacetyl)oxypropanoyloxy]butanoic acid

Drug info:

PubChemData

Smile

CC1=C(N(C2=CC=CC=C12)C3=CC4=C(C=C3)N(C5=C4C=C(C=C5)N6C7=CC=CC=C7C8=CC=CC=C86)C9=CC=CC=C9)/C=C\C#C

DOS

IR

Vibrations