Geometry & MOs

Info

ID:	390976
PubChem CID:	135001958
Reduced:	NOF2H7C11 (1)
Stoich.:	ABC2D7E11 (1)
Weight, g/mol:	451.23185
ΔH_f, kcal/mol:	-41.88
Dipole, Da:	4.86
IP(EA), eV:	-9.24(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-5-[(2-methylpropan-2-yl)oxycarbonylamino]-2-[[(2R)-2-(phenylmethoxycarbonylamino)propanoyl]amino]pentanoate

Drug info:

PubChemData

Smile

C1=CC=[N+](C(=C1)C2=CC(=C(C=C2)F)F)[O-]

DOS

IR

Vibrations