Geometry & MOs

Info

ID:	190846
PubChem CID:	78067986
Reduced:	OC7H7 (2)
Stoich.:	AB7C7 (2)
Weight, g/mol:	512.213181
ΔH_f, kcal/mol:	-33.37
Dipole, Da:	2.47
IP(EA), eV:	-9.56(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-[[2-[[2-[[2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]acetyl]amino]acetyl]amino]acetyl]amino]-3-(1H-indol-3-yl)propanoic acid

Drug info:

PubChemData

Smile

C1CC2C=CC1C(O2)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations