Geometry & MOs

Info

ID:	149966
PubChem CID:	53789649
Reduced:	OF2N6C14H16 (1)
Stoich.:	AB2C6D14E16 (1)
Weight, g/mol:	274.141638
ΔH_f, kcal/mol:	-18.94
Dipole, Da:	7.18
IP(EA), eV:	-9.9(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-2-[(2-methylpropan-2-yl)oxycarbonyl]-3-(2-methylpropyl)butanedioic acid

Drug info:

PubChemData

Smile

C[C@H]([C@](CN1C=NC=N1)(C2=C(C=C(C=C2)F)F)O)N3CCN=N3

DOS

IR

Vibrations