Geometry & MOs

Info

ID:	149932
PubChem CID:	53789614
Reduced:	NO2C17H33 (1)
Stoich.:	AB2C17D33 (1)
Weight, g/mol:	479.237998
ΔH_f, kcal/mol:	-157.33
Dipole, Da:	2.63
IP(EA), eV:	-9.49(1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[(2-aminoacetyl)amino]-3-phenylmethoxypropanoyl]amino]acetyl]amino]propanoyl]amino]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCC(=O)OC1CCCCN1

DOS

IR

Vibrations