Geometry & MOs

Info

ID:	188546
PubChem CID:	77731505
Reduced:	NOF2C21H23 (1)
Stoich.:	ABC2D21E23 (1)
Weight, g/mol:	470.241687
ΔH_f, kcal/mol:	-94.96
Dipole, Da:	2.61
IP(EA), eV:	-9.1(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-6-[bis(3-phenylpropanoyl)amino]-6,6-dimethoxyhexanoic acid

Drug info:

PubChemData

Smile

CN1C2CCC1C(C(C2)OC(C3=CC=CC=C3)C4=CC=C(C=C4)F)F

DOS

IR

Vibrations